data_nef_c25240_2mv2 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MV2 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ALA middle . . 3 A 3 SER middle . . 4 A 4 GLY middle . false 5 A 5 VAL middle . . 6 A 6 THR middle . . 7 A 7 VAL middle . . 8 A 8 SER middle . . 9 A 9 ASP middle . . 10 A 10 VAL middle . . 11 A 11 CYS middle . . 12 A 12 LYS middle . . 13 A 13 THR middle . . 14 A 14 THR middle . . 15 A 15 TYR middle . . 16 A 16 GLU middle . . 17 A 17 GLU middle . . 18 A 18 ILE middle . . 19 A 19 LYS middle . . 20 A 20 LYS middle . . 21 A 21 ASP middle . . 22 A 22 LYS middle . . 23 A 23 LYS middle . . 24 A 24 HIS middle . . 25 A 25 ARG middle . . 26 A 26 TYR middle . . 27 A 27 VAL middle . . 28 A 28 ILE middle . . 29 A 29 PHE middle . . 30 A 30 TYR middle . . 31 A 31 ILE middle . . 32 A 32 ARG middle . . 33 A 33 ASP middle . . 34 A 34 GLU middle . . 35 A 35 LYS middle . . 36 A 36 GLN middle . . 37 A 37 ILE middle . . 38 A 38 ASP middle . . 39 A 39 VAL middle . . 40 A 40 GLU middle . . 41 A 41 THR middle . . 42 A 42 VAL middle . . 43 A 43 ALA middle . . 44 A 44 ASP middle . . 45 A 45 ARG middle . . 46 A 46 ASN middle . . 47 A 47 ALA middle . . 48 A 48 GLU middle . . 49 A 49 TYR middle . . 50 A 50 ASP middle . . 51 A 51 GLN middle . . 52 A 52 PHE middle . . 53 A 53 LEU middle . . 54 A 54 GLU middle . . 55 A 55 ASP middle . . 56 A 56 ILE middle . . 57 A 57 GLN middle . . 58 A 58 LYS middle . . 59 A 59 CYS middle . . 60 A 60 GLY middle . false 61 A 61 PRO middle . false 62 A 62 GLY middle . false 63 A 63 GLU middle . . 64 A 64 CYS middle . . 65 A 65 ARG middle . . 66 A 66 TYR middle . . 67 A 67 GLY middle . false 68 A 68 LEU middle . . 69 A 69 PHE middle . . 70 A 70 ASP middle . . 71 A 71 PHE middle . . 72 A 72 GLU middle . . 73 A 73 TYR middle . . 74 A 74 MET middle . . 75 A 75 HIS middle . . 76 A 76 GLN middle . . 77 A 77 CYS middle . . 78 A 78 GLN middle . . 79 A 79 GLY middle . false 80 A 80 THR middle . . 81 A 81 SER middle . . 82 A 82 GLU middle . . 83 A 83 SER middle . . 84 A 84 SER middle . . 85 A 85 LYS middle . . 86 A 86 LYS middle . . 87 A 87 GLN middle . . 88 A 88 LYS middle . . 89 A 89 LEU middle . . 90 A 90 PHE middle . . 91 A 91 LEU middle . . 92 A 92 MET middle . . 93 A 93 SER middle . . 94 A 94 TRP middle . . 95 A 95 CYS middle . . 96 A 96 PRO middle . false 97 A 97 ASP middle . . 98 A 98 THR middle . . 99 A 99 ALA middle . . 100 A 100 LYS middle . . 101 A 101 VAL middle . . 102 A 102 LYS middle . . 103 A 103 LYS middle . . 104 A 104 LYS middle . . 105 A 105 MET middle . . 106 A 106 LEU middle . . 107 A 107 TYR middle . . 108 A 108 SER middle . . 109 A 109 SER middle . . 110 A 110 SER middle . . 111 A 111 PHE middle . . 112 A 112 ASP middle . . 113 A 113 ALA middle . . 114 A 114 LEU middle . . 115 A 115 LYS middle . . 116 A 116 LYS middle . . 117 A 117 SER middle . . 118 A 118 LEU middle . . 119 A 119 VAL middle . . 120 A 120 GLY middle . false 121 A 121 VAL middle . . 122 A 122 GLN middle . . 123 A 123 LYS middle . . 124 A 124 TYR middle . . 125 A 125 ILE middle . . 126 A 126 GLN middle . . 127 A 127 ALA middle . . 128 A 128 THR middle . . 129 A 129 ASP middle . . 130 A 130 LEU middle . . 131 A 131 SER middle . . 132 A 132 GLU middle . . 133 A 133 ALA middle . . 134 A 134 SER middle . . 135 A 135 ARG middle . . 136 A 136 GLU middle . . 137 A 137 ALA middle . . 138 A 138 VAL middle . . 139 A 139 GLU middle . . 140 A 140 GLU middle . . 141 A 141 LYS middle . . 142 A 142 LEU middle . . 143 A 143 ARG middle . . 144 A 144 ALA middle . . 145 A 145 THR middle . . 146 A 146 ASP middle . . 147 A 147 ARG middle . . 148 A 148 GLN end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET H1 H 1 8.370 0.020 A 1 MET HA H 1 4.299 0.020 A 1 MET HB2 H 1 2.515 0.020 A 1 MET HB3 H 1 2.515 0.020 A 1 MET HG2 H 1 1.892 0.020 A 1 MET HG3 H 1 1.892 0.020 A 1 MET C C 13 175.960 0.3 A 1 MET CA C 13 55.304 0.3 A 1 MET CB C 13 32.870 0.3 A 1 MET CG C 13 31.725 0.3 A 1 MET N N 15 119.996 0.3 A 2 ALA H H 1 8.306 0.020 A 2 ALA HA H 1 4.207 0.020 A 2 ALA HB% H 1 1.254 0.020 A 2 ALA C C 13 177.605 0.3 A 2 ALA CA C 13 52.442 0.3 A 2 ALA CB C 13 19.135 0.3 A 2 ALA N N 15 126.020 0.3 A 3 SER H H 1 8.183 0.020 A 3 SER HA H 1 4.282 0.020 A 3 SER HBy H 1 3.760 0.020 A 3 SER HBx H 1 3.718 0.020 A 3 SER C C 13 174.965 0.3 A 3 SER CA C 13 58.165 0.3 A 3 SER CB C 13 64.003 0.3 A 3 SER N N 15 115.214 0.3 A 4 GLY H H 1 8.279 0.020 A 4 GLY HAx H 1 3.768 0.020 A 4 GLY HAy H 1 3.930 0.020 A 4 GLY C C 13 173.716 0.3 A 4 GLY CA C 13 45.003 0.3 A 4 GLY N N 15 110.858 0.3 A 5 VAL H H 1 7.672 0.020 A 5 VAL HA H 1 4.128 0.020 A 5 VAL HB H 1 1.668 0.020 A 5 VAL HG1% H 1 0.586 0.020 A 5 VAL HG2% H 1 0.586 0.020 A 5 VAL C C 13 176.275 0.3 A 5 VAL CA C 13 62.172 0.3 A 5 VAL CB C 13 32.641 0.3 A 5 VAL CG1 C 13 21.653 0.3 A 5 VAL CG2 C 13 21.653 0.3 A 5 VAL N N 15 119.961 0.3 A 6 THR H H 1 7.756 0.020 A 6 THR HA H 1 4.487 0.020 A 6 THR HB H 1 4.196 0.020 A 6 THR HG2% H 1 1.092 0.020 A 6 THR C C 13 173.252 0.3 A 6 THR CA C 13 59.882 0.3 A 6 THR CB C 13 71.328 0.3 A 6 THR CG2 C 13 21.653 0.3 A 6 THR N N 15 115.480 0.3 A 7 VAL H H 1 8.447 0.020 A 7 VAL HA H 1 4.079 0.020 A 7 VAL HB H 1 1.776 0.020 A 7 VAL HGx% H 1 0.784 0.020 A 7 VAL HGy% H 1 0.545 0.020 A 7 VAL C C 13 176.215 0.3 A 7 VAL CA C 13 62.057 0.3 A 7 VAL CB C 13 33.557 0.3 A 7 VAL CG1 C 13 21.195 0.3 A 7 VAL CG2 C 13 21.195 0.3 A 7 VAL N N 15 120.262 0.3 A 8 SER H H 1 8.816 0.020 A 8 SER HA H 1 4.271 0.020 A 8 SER HBy H 1 4.119 0.020 A 8 SER HBx H 1 3.914 0.020 A 8 SER C C 13 175.892 0.3 A 8 SER CA C 13 58.738 0.3 A 8 SER CB C 13 64.003 0.3 A 8 SER N N 15 124.247 0.3 A 9 ASP H H 1 9.033 0.020 A 9 ASP HA H 1 4.309 0.020 A 9 ASP HBy H 1 2.674 0.020 A 9 ASP HBx H 1 2.611 0.020 A 9 ASP C C 13 178.492 0.3 A 9 ASP CA C 13 57.937 0.3 A 9 ASP CB C 13 40.195 0.3 A 9 ASP N N 15 125.176 0.3 A 10 VAL H H 1 8.078 0.020 A 10 VAL HA H 1 4.094 0.020 A 10 VAL HB H 1 2.099 0.020 A 10 VAL HGx% H 1 0.993 0.020 A 10 VAL HGy% H 1 1.014 0.020 A 10 VAL C C 13 179.439 0.3 A 10 VAL CA C 13 64.575 0.3 A 10 VAL CB C 13 31.496 0.3 A 10 VAL CG1 C 13 20.623 0.3 A 10 VAL CG2 C 13 22.454 0.3 A 10 VAL N N 15 117.738 0.3 A 11 CYS H H 1 7.922 0.020 A 11 CYS HA H 1 3.914 0.020 A 11 CYS HB2 H 1 3.042 0.020 A 11 CYS HB3 H 1 3.042 0.020 A 11 CYS C C 13 176.094 0.3 A 11 CYS CA C 13 63.774 0.3 A 11 CYS CB C 13 27.032 0.3 A 11 CYS N N 15 121.775 0.3 A 12 LYS H H 1 7.010 0.020 A 12 LYS HA H 1 3.914 0.020 A 12 LYS HB2 H 1 1.973 0.020 A 12 LYS HB3 H 1 1.973 0.020 A 12 LYS HD2 H 1 1.718 0.020 A 12 LYS HD3 H 1 1.718 0.020 A 12 LYS HE2 H 1 2.896 0.020 A 12 LYS HE3 H 1 2.896 0.020 A 12 LYS HGy H 1 1.418 0.020 A 12 LYS HGx H 1 1.356 0.020 A 12 LYS C C 13 179.097 0.3 A 12 LYS CA C 13 59.768 0.3 A 12 LYS CB C 13 31.954 0.3 A 12 LYS CD C 13 29.551 0.3 A 12 LYS CE C 13 42.256 0.3 A 12 LYS CG C 13 25.659 0.3 A 12 LYS N N 15 117.392 0.3 A 13 THR H H 1 8.309 0.020 A 13 THR HA H 1 3.951 0.020 A 13 THR HB H 1 4.094 0.020 A 13 THR HG2% H 1 1.163 0.020 A 13 THR C C 13 177.424 0.3 A 13 THR CA C 13 66.063 0.3 A 13 THR CB C 13 67.666 0.3 A 13 THR CG2 C 13 22.111 0.3 A 13 THR N N 15 114.683 0.3 A 14 THR H H 1 8.138 0.020 A 14 THR HA H 1 4.015 0.020 A 14 THR HB H 1 3.951 0.020 A 14 THR HG2% H 1 0.972 0.020 A 14 THR C C 13 176.316 0.3 A 14 THR CA C 13 67.208 0.3 A 14 THR CB C 13 62.515 0.3 A 14 THR CG2 C 13 22.454 0.3 A 14 THR N N 15 118.012 0.3 A 15 TYR H H 1 7.740 0.020 A 15 TYR HA H 1 4.137 0.020 A 15 TYR HBy H 1 3.213 0.020 A 15 TYR HBx H 1 3.093 0.020 A 15 TYR HD1 H 1 7.046 0.020 A 15 TYR HD2 H 1 7.046 0.020 A 15 TYR HE1 H 1 6.605 0.020 A 15 TYR HE2 H 1 6.605 0.020 A 15 TYR C C 13 177.081 0.3 A 15 TYR CA C 13 60.684 0.3 A 15 TYR CB C 13 38.364 0.3 A 15 TYR CD1 C 13 133.449 0.3 A 15 TYR CD2 C 13 133.447 0.3 A 15 TYR CE1 C 13 117.697 0.3 A 15 TYR CE2 C 13 117.697 0.3 A 15 TYR N N 15 120.840 0.3 A 16 GLU H H 1 8.182 0.020 A 16 GLU HA H 1 3.535 0.020 A 16 GLU HBy H 1 2.057 0.020 A 16 GLU HBx H 1 1.993 0.020 A 16 GLU HG2 H 1 2.321 0.020 A 16 GLU HG3 H 1 2.321 0.020 A 16 GLU C C 13 178.673 0.3 A 16 GLU CA C 13 59.997 0.3 A 16 GLU CB C 13 28.749 0.3 A 16 GLU CG C 13 36.304 0.3 A 16 GLU N N 15 120.605 0.3 A 17 GLU H H 1 7.839 0.020 A 17 GLU HA H 1 4.121 0.020 A 17 GLU HB2 H 1 1.598 0.020 A 17 GLU HB3 H 1 1.598 0.020 A 17 GLU HG2 H 1 2.535 0.020 A 17 GLU HG3 H 1 2.535 0.020 A 17 GLU C C 13 179.399 0.3 A 17 GLU CA C 13 58.852 0.3 A 17 GLU CB C 13 29.436 0.3 A 17 GLU CG C 13 36.647 0.3 A 17 GLU N N 15 117.384 0.3 A 18 ILE H H 1 7.558 0.020 A 18 ILE HA H 1 3.533 0.020 A 18 ILE HB H 1 1.814 0.020 A 18 ILE HD1% H 1 0.519 0.020 A 18 ILE HG1y H 1 1.887 0.020 A 18 ILE HG1x H 1 1.482 0.020 A 18 ILE HG2% H 1 0.751 0.020 A 18 ILE C C 13 177.081 0.3 A 18 ILE CA C 13 66.292 0.3 A 18 ILE CB C 13 38.478 0.3 A 18 ILE CD1 C 13 13.412 0.3 A 18 ILE CG1 C 13 29.551 0.3 A 18 ILE CG2 C 13 16.846 0.3 A 18 ILE N N 15 118.004 0.3 A 19 LYS H H 1 8.387 0.020 A 19 LYS HA H 1 3.649 0.020 A 19 LYS HB2 H 1 1.525 0.020 A 19 LYS HB3 H 1 1.525 0.020 A 19 LYS HD2 H 1 1.206 0.020 A 19 LYS HD3 H 1 1.206 0.020 A 19 LYS HE2 H 1 2.759 0.020 A 19 LYS HE3 H 1 2.759 0.020 A 19 LYS HG2 H 1 1.063 0.020 A 19 LYS HG3 H 1 1.063 0.020 A 19 LYS C C 13 176.719 0.3 A 19 LYS CA C 13 59.081 0.3 A 19 LYS CB C 13 33.213 0.3 A 19 LYS CD C 13 29.093 0.3 A 19 LYS CE C 13 42.027 0.3 A 19 LYS CG C 13 23.942 0.3 A 19 LYS N N 15 121.213 0.3 A 20 LYS H H 1 8.608 0.020 A 20 LYS HA H 1 4.121 0.020 A 20 LYS HB2 H 1 1.630 0.020 A 20 LYS HB3 H 1 1.630 0.020 A 20 LYS HD2 H 1 1.251 0.020 A 20 LYS HD3 H 1 1.251 0.020 A 20 LYS HE2 H 1 2.801 0.020 A 20 LYS HE3 H 1 2.801 0.020 A 20 LYS HG2 H 1 0.780 0.020 A 20 LYS HG3 H 1 0.780 0.020 A 20 LYS C C 13 178.008 0.3 A 20 LYS CA C 13 57.937 0.3 A 20 LYS CB C 13 32.755 0.3 A 20 LYS CD C 13 28.978 0.3 A 20 LYS CE C 13 41.912 0.3 A 20 LYS CG C 13 24.743 0.3 A 20 LYS N N 15 115.307 0.3 A 21 ASP H H 1 6.395 0.020 A 21 ASP HA H 1 4.621 0.020 A 21 ASP HB2 H 1 2.579 0.020 A 21 ASP HB3 H 1 2.579 0.020 A 21 ASP C C 13 175.147 0.3 A 21 ASP CA C 13 54.732 0.3 A 21 ASP CB C 13 42.713 0.3 A 21 ASP N N 15 113.556 0.3 A 22 LYS H H 1 7.402 0.020 A 22 LYS HA H 1 3.781 0.020 A 22 LYS HB2 H 1 1.719 0.020 A 22 LYS HB3 H 1 1.719 0.020 A 22 LYS HD2 H 1 1.568 0.020 A 22 LYS HD3 H 1 1.568 0.020 A 22 LYS HE2 H 1 2.312 0.020 A 22 LYS HE3 H 1 2.312 0.020 A 22 LYS HG2 H 1 1.163 0.020 A 22 LYS HG3 H 1 1.163 0.020 A 22 LYS C C 13 176.900 0.3 A 22 LYS CA C 13 57.364 0.3 A 22 LYS CB C 13 28.864 0.3 A 22 LYS CD C 13 27.605 0.3 A 22 LYS CE C 13 40.768 0.3 A 22 LYS CG C 13 25.430 0.3 A 22 LYS N N 15 116.543 0.3 A 23 LYS H H 1 7.512 0.020 A 23 LYS HA H 1 3.554 0.020 A 23 LYS HB2 H 1 1.356 0.020 A 23 LYS HB3 H 1 1.356 0.020 A 23 LYS HD2 H 1 0.507 0.020 A 23 LYS HD3 H 1 0.507 0.020 A 23 LYS HE2 H 1 2.589 0.020 A 23 LYS HE3 H 1 2.589 0.020 A 23 LYS HG2 H 1 0.692 0.020 A 23 LYS HG3 H 1 0.692 0.020 A 23 LYS C C 13 175.106 0.3 A 23 LYS CA C 13 58.623 0.3 A 23 LYS CB C 13 34.015 0.3 A 23 LYS CD C 13 29.093 0.3 A 23 LYS CE C 13 41.798 0.3 A 23 LYS CG C 13 25.316 0.3 A 23 LYS N N 15 114.417 0.3 A 24 HIS H H 1 6.099 0.020 A 24 HIS HA H 1 3.788 0.020 A 24 HIS HB2 H 1 1.865 0.020 A 24 HIS HB3 H 1 1.865 0.020 A 24 HIS HD2 H 1 6.580 0.020 A 24 HIS C C 13 175.308 0.3 A 24 HIS CA C 13 51.298 0.3 A 24 HIS CB C 13 32.412 0.3 A 24 HIS CD2 C 13 117.475 0.3 A 24 HIS N N 15 108.361 0.3 A 25 ARG H H 1 8.066 0.020 A 25 ARG HA H 1 4.108 0.020 A 25 ARG HB2 H 1 1.231 0.020 A 25 ARG HB3 H 1 1.231 0.020 A 25 ARG HD2 H 1 2.080 0.020 A 25 ARG HD3 H 1 2.080 0.020 A 25 ARG HG2 H 1 0.579 0.020 A 25 ARG HG3 H 1 0.579 0.020 A 25 ARG C C 13 173.091 0.3 A 25 ARG CA C 13 55.189 0.3 A 25 ARG CB C 13 30.581 0.3 A 25 ARG CD C 13 45.804 0.3 A 25 ARG CG C 13 23.942 0.3 A 25 ARG N N 15 120.707 0.3 A 26 TYR H H 1 6.515 0.020 A 26 TYR HA H 1 5.066 0.020 A 26 TYR HBy H 1 3.323 0.020 A 26 TYR HBx H 1 2.681 0.020 A 26 TYR HD1 H 1 7.224 0.020 A 26 TYR HD2 H 1 7.224 0.020 A 26 TYR HE1 H 1 6.678 0.020 A 26 TYR HE2 H 1 6.678 0.020 A 26 TYR C C 13 172.224 0.3 A 26 TYR CA C 13 54.732 0.3 A 26 TYR CB C 13 41.111 0.3 A 26 TYR CD1 C 13 129.540 0.3 A 26 TYR CD2 C 13 129.540 0.3 A 26 TYR CE1 C 13 118.058 0.3 A 26 TYR CE2 C 13 118.058 0.3 A 26 TYR N N 15 106.634 0.3 A 27 VAL H H 1 8.843 0.020 A 27 VAL HA H 1 4.763 0.020 A 27 VAL HB H 1 1.524 0.020 A 27 VAL HGx% H 1 0.544 0.020 A 27 VAL HGy% H 1 0.294 0.020 A 27 VAL C C 13 173.514 0.3 A 27 VAL CA C 13 59.310 0.3 A 27 VAL CB C 13 36.189 0.3 A 27 VAL CG1 C 13 22.454 0.3 A 27 VAL CG2 C 13 22.454 0.3 A 27 VAL N N 15 116.941 0.3 A 28 ILE H H 1 8.915 0.020 A 28 ILE HA H 1 5.041 0.020 A 28 ILE HB H 1 1.942 0.020 A 28 ILE HD1% H 1 0.737 0.020 A 28 ILE HG12 H 1 1.527 0.020 A 28 ILE HG13 H 1 1.527 0.020 A 28 ILE HG2% H 1 1.080 0.020 A 28 ILE C C 13 175.590 0.3 A 28 ILE CA C 13 58.394 0.3 A 28 ILE CB C 13 38.135 0.3 A 28 ILE CD1 C 13 17.876 0.3 A 28 ILE CG1 C 13 27.605 0.3 A 28 ILE CG2 C 13 17.876 0.3 A 28 ILE N N 15 125.708 0.3 A 29 PHE H H 1 9.597 0.020 A 29 PHE HA H 1 5.860 0.020 A 29 PHE HBy H 1 3.421 0.020 A 29 PHE HBx H 1 3.054 0.020 A 29 PHE HDx H 1 7.075 0.020 A 29 PHE HDy H 1 7.077 0.020 A 29 PHE C C 13 173.958 0.3 A 29 PHE CA C 13 55.991 0.3 A 29 PHE CB C 13 42.599 0.3 A 29 PHE CD1 C 13 130.942 0.3 A 29 PHE CD2 C 13 130.942 0.3 A 29 PHE CE1 C 13 130.942 0.3 A 29 PHE CE2 C 13 130.942 0.3 A 29 PHE N N 15 125.649 0.3 A 30 TYR H H 1 9.556 0.020 A 30 TYR HA H 1 5.383 0.020 A 30 TYR HB2 H 1 2.838 0.020 A 30 TYR HB3 H 1 2.838 0.020 A 30 TYR HD1 H 1 6.916 0.020 A 30 TYR HD2 H 1 6.916 0.020 A 30 TYR HE1 H 1 6.583 0.020 A 30 TYR HE2 H 1 6.583 0.020 A 30 TYR C C 13 176.840 0.3 A 30 TYR CA C 13 54.503 0.3 A 30 TYR CB C 13 42.027 0.3 A 30 TYR CD1 C 13 128.632 0.3 A 30 TYR CD2 C 13 128.632 0.3 A 30 TYR CE1 C 13 119.188 0.3 A 30 TYR CE2 C 13 119.188 0.3 A 30 TYR N N 15 120.134 0.3 A 31 ILE H H 1 8.475 0.020 A 31 ILE HA H 1 4.081 0.020 A 31 ILE HB H 1 2.385 0.020 A 31 ILE HD1% H 1 -0.150 0.020 A 31 ILE HG12 H 1 1.139 0.020 A 31 ILE HG13 H 1 1.139 0.020 A 31 ILE HG2% H 1 0.294 0.020 A 31 ILE C C 13 174.562 0.3 A 31 ILE CA C 13 61.141 0.3 A 31 ILE CB C 13 37.105 0.3 A 31 ILE CD1 C 13 14.671 0.3 A 31 ILE CG1 C 13 25.659 0.3 A 31 ILE CG2 C 13 17.876 0.3 A 31 ILE N N 15 118.577 0.3 A 32 ARG H H 1 8.994 0.020 A 32 ARG HA H 1 4.257 0.020 A 32 ARG HBy H 1 2.118 0.020 A 32 ARG HBx H 1 1.681 0.020 A 32 ARG HD2 H 1 3.155 0.020 A 32 ARG HD3 H 1 3.155 0.020 A 32 ARG HGy H 1 1.273 0.020 A 32 ARG HGx H 1 1.187 0.020 A 32 ARG C C 13 176.557 0.3 A 32 ARG CA C 13 55.304 0.3 A 32 ARG CB C 13 31.496 0.3 A 32 ARG CD C 13 43.400 0.3 A 32 ARG CG C 13 26.804 0.3 A 32 ARG N N 15 132.544 0.3 A 33 ASP H H 1 9.442 0.020 A 33 ASP HA H 1 4.257 0.020 A 33 ASP HBy H 1 2.823 0.020 A 33 ASP HBx H 1 2.475 0.020 A 33 ASP C C 13 173.615 0.3 A 33 ASP CA C 13 55.876 0.3 A 33 ASP CB C 13 39.966 0.3 A 33 ASP N N 15 128.042 0.3 A 34 GLU H H 1 8.532 0.020 A 34 GLU HA H 1 4.533 0.020 A 34 GLU HBy H 1 2.057 0.020 A 34 GLU HBx H 1 1.946 0.020 A 34 GLU HG2 H 1 3.212 0.020 A 34 GLU HG3 H 1 3.212 0.020 A 34 GLU C C 13 174.844 0.3 A 34 GLU CA C 13 58.394 0.3 A 34 GLU CB C 13 27.605 0.3 A 34 GLU CG C 13 36.990 0.3 A 34 GLU N N 15 108.952 0.3 A 35 LYS H H 1 7.911 0.020 A 35 LYS HA H 1 4.533 0.020 A 35 LYS HB2 H 1 2.185 0.020 A 35 LYS HB3 H 1 2.185 0.020 A 35 LYS HD2 H 1 1.577 0.020 A 35 LYS HD3 H 1 1.577 0.020 A 35 LYS HE2 H 1 2.840 0.020 A 35 LYS HE3 H 1 2.840 0.020 A 35 LYS HG2 H 1 1.312 0.020 A 35 LYS HG3 H 1 1.312 0.020 A 35 LYS C C 13 175.530 0.3 A 35 LYS CA C 13 57.364 0.3 A 35 LYS CB C 13 36.533 0.3 A 35 LYS CD C 13 29.207 0.3 A 35 LYS CE C 13 42.141 0.3 A 35 LYS CG C 13 24.171 0.3 A 35 LYS N N 15 114.285 0.3 A 36 GLN H H 1 7.483 0.020 A 36 GLN HA H 1 5.027 0.020 A 36 GLN HBy H 1 1.709 0.020 A 36 GLN HBx H 1 1.589 0.020 A 36 GLN HG2 H 1 1.933 0.020 A 36 GLN HG3 H 1 1.933 0.020 A 36 GLN C C 13 174.139 0.3 A 36 GLN CA C 13 54.503 0.3 A 36 GLN CB C 13 33.213 0.3 A 36 GLN CG C 13 34.701 0.3 A 36 GLN N N 15 118.851 0.3 A 37 ILE H H 1 9.208 0.020 A 37 ILE HA H 1 4.295 0.020 A 37 ILE HB H 1 1.550 0.020 A 37 ILE HD1% H 1 0.863 0.020 A 37 ILE HG12 H 1 1.520 0.020 A 37 ILE HG13 H 1 1.520 0.020 A 37 ILE HG2% H 1 0.863 0.020 A 37 ILE C C 13 173.333 0.3 A 37 ILE CA C 13 62.286 0.3 A 37 ILE CB C 13 38.021 0.3 A 37 ILE CD1 C 13 14.785 0.3 A 37 ILE CG1 C 13 29.551 0.3 A 37 ILE CG2 C 13 18.791 0.3 A 37 ILE N N 15 127.682 0.3 A 38 ASP H H 1 9.380 0.020 A 38 ASP HA H 1 5.037 0.020 A 38 ASP HBy H 1 2.413 0.020 A 38 ASP HBx H 1 2.090 0.020 A 38 ASP C C 13 175.147 0.3 A 38 ASP CA C 13 51.870 0.3 A 38 ASP CB C 13 45.918 0.3 A 38 ASP N N 15 128.702 0.3 A 39 VAL H H 1 8.769 0.020 A 39 VAL HA H 1 3.867 0.020 A 39 VAL HB H 1 1.804 0.020 A 39 VAL HGx% H 1 0.957 0.020 A 39 VAL HGy% H 1 0.553 0.020 A 39 VAL C C 13 175.268 0.3 A 39 VAL CA C 13 63.888 0.3 A 39 VAL CB C 13 33.671 0.3 A 39 VAL CG1 C 13 23.713 0.3 A 39 VAL CG2 C 13 21.653 0.3 A 39 VAL N N 15 122.387 0.3 A 40 GLU H H 1 9.512 0.020 A 40 GLU HA H 1 4.267 0.020 A 40 GLU HB2 H 1 1.548 0.020 A 40 GLU HB3 H 1 1.548 0.020 A 40 GLU HG2 H 1 1.791 0.020 A 40 GLU HG3 H 1 1.791 0.020 A 40 GLU C C 13 175.711 0.3 A 40 GLU CA C 13 57.708 0.3 A 40 GLU CB C 13 32.755 0.3 A 40 GLU CG C 13 37.219 0.3 A 40 GLU N N 15 128.576 0.3 A 41 THR H H 1 7.277 0.020 A 41 THR HA H 1 4.423 0.020 A 41 THR HB H 1 3.645 0.020 A 41 THR HG2% H 1 0.957 0.020 A 41 THR C C 13 171.559 0.3 A 41 THR CA C 13 61.256 0.3 A 41 THR CB C 13 71.901 0.3 A 41 THR CG2 C 13 21.767 0.3 A 41 THR N N 15 111.962 0.3 A 42 VAL H H 1 8.264 0.020 A 42 VAL HA H 1 4.243 0.020 A 42 VAL HB H 1 1.352 0.020 A 42 VAL HGx% H 1 0.408 0.020 A 42 VAL HGy% H 1 0.066 0.020 A 42 VAL C C 13 173.877 0.3 A 42 VAL CA C 13 60.684 0.3 A 42 VAL CB C 13 34.015 0.3 A 42 VAL CG1 C 13 20.852 0.3 A 42 VAL CG2 C 13 20.852 0.3 A 42 VAL N N 15 123.660 0.3 A 43 ALA H H 1 7.420 0.020 A 43 ALA HA H 1 4.436 0.020 A 43 ALA HB% H 1 0.184 0.020 A 43 ALA C C 13 176.759 0.3 A 43 ALA CA C 13 50.153 0.3 A 43 ALA CB C 13 20.737 0.3 A 43 ALA N N 15 126.970 0.3 A 44 ASP H H 1 8.285 0.020 A 44 ASP HA H 1 4.575 0.020 A 44 ASP HBy H 1 2.752 0.020 A 44 ASP HBx H 1 2.586 0.020 A 44 ASP C C 13 175.771 0.3 A 44 ASP CA C 13 54.159 0.3 A 44 ASP CB C 13 41.798 0.3 A 44 ASP N N 15 120.831 0.3 A 45 ARG H H 1 8.020 0.020 A 45 ARG HA H 1 3.560 0.020 A 45 ARG HBy H 1 1.788 0.020 A 45 ARG HBx H 1 1.405 0.020 A 45 ARG HD2 H 1 2.567 0.020 A 45 ARG HD3 H 1 2.567 0.020 A 45 ARG HGy H 1 0.913 0.020 A 45 ARG HGx H 1 0.771 0.020 A 45 ARG C C 13 175.764 0.3 A 45 ARG CA C 13 56.792 0.3 A 45 ARG CB C 13 30.008 0.3 A 45 ARG CD C 13 42.713 0.3 A 45 ARG CG C 13 24.629 0.3 A 45 ARG N N 15 118.015 0.3 A 46 ASN H H 1 8.184 0.020 A 46 ASN HA H 1 4.654 0.020 A 46 ASN HB2 H 1 2.739 0.020 A 46 ASN HB3 H 1 2.739 0.020 A 46 ASN C C 13 175.090 0.3 A 46 ASN CA C 13 52.900 0.3 A 46 ASN CB C 13 37.792 0.3 A 46 ASN N N 15 113.620 0.3 A 47 ALA H H 1 7.515 0.020 A 47 ALA HA H 1 4.207 0.020 A 47 ALA HB% H 1 1.370 0.020 A 47 ALA C C 13 176.472 0.3 A 47 ALA CA C 13 53.015 0.3 A 47 ALA CB C 13 20.966 0.3 A 47 ALA N N 15 124.076 0.3 A 48 GLU H H 1 8.327 0.020 A 48 GLU HA H 1 4.778 0.020 A 48 GLU HB2 H 1 1.989 0.020 A 48 GLU HB3 H 1 1.989 0.020 A 48 GLU HGy H 1 2.435 0.020 A 48 GLU HGx H 1 2.288 0.020 A 48 GLU C C 13 178.259 0.3 A 48 GLU CA C 13 54.732 0.3 A 48 GLU CB C 13 32.755 0.3 A 48 GLU CG C 13 36.418 0.3 A 48 GLU N N 15 117.871 0.3 A 49 TYR H H 1 9.164 0.020 A 49 TYR HA H 1 3.835 0.020 A 49 TYR HB2 H 1 2.812 0.020 A 49 TYR HB3 H 1 2.812 0.020 A 49 TYR HD1 H 1 7.217 0.020 A 49 TYR HD2 H 1 7.217 0.020 A 49 TYR C C 13 176.809 0.3 A 49 TYR CA C 13 62.744 0.3 A 49 TYR CB C 13 38.250 0.3 A 49 TYR CD1 C 13 131.910 0.3 A 49 TYR CD2 C 13 131.910 0.3 A 49 TYR N N 15 122.704 0.3 A 50 ASP H H 1 8.516 0.020 A 50 ASP HA H 1 4.137 0.020 A 50 ASP HBy H 1 2.548 0.020 A 50 ASP HBx H 1 2.435 0.020 A 50 ASP C C 13 178.832 0.3 A 50 ASP CA C 13 57.364 0.3 A 50 ASP CB C 13 39.737 0.3 A 50 ASP N N 15 114.152 0.3 A 51 GLN H H 1 7.290 0.020 A 51 GLN HA H 1 3.912 0.020 A 51 GLN HB2 H 1 1.377 0.020 A 51 GLN HB3 H 1 1.377 0.020 A 51 GLN HGy H 1 2.541 0.020 A 51 GLN HGx H 1 2.329 0.020 A 51 GLN C C 13 177.180 0.3 A 51 GLN CA C 13 58.852 0.3 A 51 GLN CB C 13 28.864 0.3 A 51 GLN CG C 13 35.045 0.3 A 51 GLN N N 15 120.262 0.3 A 52 PHE H H 1 6.926 0.020 A 52 PHE HA H 1 3.247 0.020 A 52 PHE HB2 H 1 1.975 0.020 A 52 PHE HB3 H 1 1.975 0.020 A 52 PHE HD1 H 1 6.495 0.020 A 52 PHE HD2 H 1 6.495 0.020 A 52 PHE HE1 H 1 6.495 0.020 A 52 PHE HE2 H 1 6.495 0.020 A 52 PHE C C 13 175.697 0.3 A 52 PHE CA C 13 60.569 0.3 A 52 PHE CB C 13 38.593 0.3 A 52 PHE CD1 C 13 135.193 0.3 A 52 PHE CD2 C 13 135.193 0.3 A 52 PHE CE1 C 13 135.193 0.3 A 52 PHE CE2 C 13 135.193 0.3 A 52 PHE N N 15 121.864 0.3 A 53 LEU H H 1 7.382 0.020 A 53 LEU HA H 1 3.193 0.020 A 53 LEU HB2 H 1 1.440 0.020 A 53 LEU HB3 H 1 1.440 0.020 A 53 LEU HDx% H 1 0.673 0.020 A 53 LEU HDy% H 1 0.397 0.020 A 53 LEU HG H 1 1.440 0.020 A 53 LEU C C 13 179.877 0.3 A 53 LEU CA C 13 56.449 0.3 A 53 LEU CB C 13 41.340 0.3 A 53 LEU CD1 C 13 24.972 0.3 A 53 LEU CD2 C 13 21.996 0.3 A 53 LEU CG C 13 26.231 0.3 A 53 LEU N N 15 116.512 0.3 A 54 GLU H H 1 7.275 0.020 A 54 GLU HA H 1 3.658 0.020 A 54 GLU HB2 H 1 1.919 0.020 A 54 GLU HB3 H 1 1.919 0.020 A 54 GLU HG2 H 1 2.158 0.020 A 54 GLU HG3 H 1 2.158 0.020 A 54 GLU C C 13 179.371 0.3 A 54 GLU CA C 13 59.244 0.3 A 54 GLU CB C 13 28.978 0.3 A 54 GLU CG C 13 36.189 0.3 A 54 GLU N N 15 119.308 0.3 A 55 ASP H H 1 8.354 0.020 A 55 ASP HA H 1 4.313 0.020 A 55 ASP HBy H 1 2.938 0.020 A 55 ASP HBx H 1 2.769 0.020 A 55 ASP C C 13 179.573 0.3 A 55 ASP CA C 13 57.364 0.3 A 55 ASP CB C 13 40.195 0.3 A 55 ASP N N 15 119.986 0.3 A 56 ILE H H 1 8.093 0.020 A 56 ILE HA H 1 3.473 0.020 A 56 ILE HB H 1 1.960 0.020 A 56 ILE HD1% H 1 0.702 0.020 A 56 ILE HG12 H 1 1.366 0.020 A 56 ILE HG13 H 1 1.366 0.020 A 56 ILE HG2% H 1 0.567 0.020 A 56 ILE C C 13 173.674 0.3 A 56 ILE CA C 13 64.461 0.3 A 56 ILE CB C 13 36.762 0.3 A 56 ILE CD1 C 13 13.297 0.3 A 56 ILE CG1 C 13 27.261 0.3 A 56 ILE CG2 C 13 14.671 0.3 A 56 ILE N N 15 121.615 0.3 A 57 GLN H H 1 6.377 0.020 A 57 GLN HA H 1 4.147 0.020 A 57 GLN HB2 H 1 1.667 0.020 A 57 GLN HB3 H 1 1.667 0.020 A 57 GLN HG2 H 1 1.834 0.020 A 57 GLN HG3 H 1 1.834 0.020 A 57 GLN C C 13 178.899 0.3 A 57 GLN CA C 13 55.991 0.3 A 57 GLN CB C 13 31.954 0.3 A 57 GLN CG C 13 35.274 0.3 A 57 GLN N N 15 113.032 0.3 A 58 LYS H H 1 7.280 0.020 A 58 LYS HA H 1 3.842 0.020 A 58 LYS HB2 H 1 1.775 0.020 A 58 LYS HB3 H 1 1.775 0.020 A 58 LYS HD2 H 1 1.366 0.020 A 58 LYS HD3 H 1 1.366 0.020 A 58 LYS HE2 H 1 2.792 0.020 A 58 LYS HE3 H 1 2.792 0.020 A 58 LYS HG2 H 1 0.784 0.020 A 58 LYS HG3 H 1 0.784 0.020 A 58 LYS C C 13 176.674 0.3 A 58 LYS CA C 13 59.424 0.3 A 58 LYS CB C 13 32.069 0.3 A 58 LYS CD C 13 29.436 0.3 A 58 LYS CE C 13 42.141 0.3 A 58 LYS CG C 13 24.972 0.3 A 58 LYS N N 15 122.152 0.3 A 59 CYS H H 1 7.784 0.020 A 59 CYS HA H 1 4.146 0.020 A 59 CYS HBy H 1 2.802 0.020 A 59 CYS HBx H 1 2.598 0.020 A 59 CYS C C 13 175.056 0.3 A 59 CYS CA C 13 58.623 0.3 A 59 CYS CB C 13 26.918 0.3 A 59 CYS N N 15 116.543 0.3 A 60 GLY H H 1 7.542 0.020 A 60 GLY HAy H 1 4.313 0.020 A 60 GLY HAx H 1 3.904 0.020 A 60 GLY CA C 13 42.318 0.3 A 60 GLY N N 15 109.550 0.3 A 61 PRO HA H 1 4.228 0.020 A 61 PRO HB2 H 1 2.163 0.020 A 61 PRO HB3 H 1 2.163 0.020 A 61 PRO HG2 H 1 1.880 0.020 A 61 PRO HG3 H 1 1.880 0.020 A 61 PRO C C 13 177.079 0.3 A 61 PRO CA C 13 64.117 0.3 A 61 PRO CB C 13 31.496 0.3 A 61 PRO CG C 13 27.147 0.3 A 62 GLY H H 1 8.479 0.020 A 62 GLY HAy H 1 4.032 0.020 A 62 GLY HAx H 1 3.608 0.020 A 62 GLY C C 13 174.011 0.3 A 62 GLY CA C 13 45.117 0.3 A 62 GLY N N 15 106.490 0.3 A 63 GLU H H 1 7.001 0.020 A 63 GLU HA H 1 4.298 0.020 A 63 GLU HB2 H 1 1.401 0.020 A 63 GLU HB3 H 1 1.401 0.020 A 63 GLU HG2 H 1 1.916 0.020 A 63 GLU HG3 H 1 1.916 0.020 A 63 GLU C C 13 173.775 0.3 A 63 GLU CA C 13 54.961 0.3 A 63 GLU CB C 13 33.557 0.3 A 63 GLU CG C 13 36.189 0.3 A 63 GLU N N 15 119.465 0.3 A 64 CYS H H 1 6.622 0.020 A 64 CYS HA H 1 4.509 0.020 A 64 CYS HBy H 1 2.228 0.020 A 64 CYS HBx H 1 0.737 0.020 A 64 CYS C C 13 173.371 0.3 A 64 CYS CA C 13 55.647 0.3 A 64 CYS CB C 13 31.267 0.3 A 64 CYS N N 15 111.402 0.3 A 65 ARG H H 1 8.621 0.020 A 65 ARG HA H 1 4.674 0.020 A 65 ARG HB2 H 1 1.779 0.020 A 65 ARG HB3 H 1 1.779 0.020 A 65 ARG HD2 H 1 2.818 0.020 A 65 ARG HD3 H 1 2.818 0.020 A 65 ARG HG2 H 1 1.525 0.020 A 65 ARG HG3 H 1 1.525 0.020 A 65 ARG C C 13 174.820 0.3 A 65 ARG CA C 13 53.587 0.3 A 65 ARG CB C 13 39.737 0.3 A 65 ARG CD C 13 42.485 0.3 A 65 ARG N N 15 117.835 0.3 A 66 TYR H H 1 8.256 0.020 A 66 TYR HA H 1 6.075 0.020 A 66 TYR HBy H 1 3.262 0.020 A 66 TYR HBx H 1 2.951 0.020 A 66 TYR HD1 H 1 6.575 0.020 A 66 TYR HD2 H 1 6.575 0.020 A 66 TYR HEx H 1 6.714 0.020 A 66 TYR HEy H 1 6.714 0.020 A 66 TYR C C 13 176.068 0.3 A 66 TYR CA C 13 54.846 0.3 A 66 TYR CB C 13 41.798 0.3 A 66 TYR CD1 C 13 130.594 0.3 A 66 TYR CD2 C 13 130.594 0.3 A 66 TYR CE1 C 13 123.343 0.3 A 66 TYR CE2 C 13 123.343 0.3 A 66 TYR N N 15 114.314 0.3 A 67 GLY H H 1 9.831 0.020 A 67 GLY HAy H 1 5.650 0.020 A 67 GLY HAx H 1 3.809 0.020 A 67 GLY C C 13 170.135 0.3 A 67 GLY CA C 13 45.575 0.3 A 67 GLY N N 15 107.717 0.3 A 68 LEU H H 1 9.391 0.020 A 68 LEU HA H 1 5.494 0.020 A 68 LEU HB2 H 1 1.979 0.020 A 68 LEU HB3 H 1 1.979 0.020 A 68 LEU HD1% H 1 1.520 0.020 A 68 LEU HD2% H 1 1.520 0.020 A 68 LEU HG H 1 1.923 0.020 A 68 LEU C C 13 173.674 0.3 A 68 LEU CA C 13 53.324 0.3 A 68 LEU CB C 13 47.177 0.3 A 68 LEU CD1 C 13 25.545 0.3 A 68 LEU CD2 C 13 25.545 0.3 A 68 LEU CG C 13 27.376 0.3 A 68 LEU N N 15 127.494 0.3 A 69 PHE H H 1 8.017 0.020 A 69 PHE HA H 1 4.503 0.020 A 69 PHE HB2 H 1 3.823 0.020 A 69 PHE HB3 H 1 3.823 0.020 A 69 PHE HD1 H 1 7.013 0.020 A 69 PHE HD2 H 1 7.013 0.020 A 69 PHE HE1 H 1 7.013 0.020 A 69 PHE HE2 H 1 7.013 0.020 A 69 PHE C C 13 172.629 0.3 A 69 PHE CA C 13 56.334 0.3 A 69 PHE CB C 13 43.744 0.3 A 69 PHE CD1 C 13 132.436 0.3 A 69 PHE CD2 C 13 132.436 0.3 A 69 PHE CE1 C 13 132.436 0.3 A 69 PHE CE2 C 13 132.436 0.3 A 69 PHE N N 15 126.775 0.3 A 70 ASP H H 1 7.087 0.020 A 70 ASP HA H 1 4.791 0.020 A 70 ASP HB2 H 1 2.749 0.020 A 70 ASP HB3 H 1 2.749 0.020 A 70 ASP C C 13 172.764 0.3 A 70 ASP CA C 13 53.129 0.3 A 70 ASP CB C 13 40.653 0.3 A 70 ASP N N 15 126.639 0.3 A 71 PHE H H 1 8.656 0.020 A 71 PHE HA H 1 4.696 0.020 A 71 PHE HBy H 1 3.717 0.020 A 71 PHE HBx H 1 3.121 0.020 A 71 PHE HDx H 1 6.982 0.020 A 71 PHE HDy H 1 6.982 0.020 A 71 PHE HE1 H 1 6.982 0.020 A 71 PHE HE2 H 1 6.982 0.020 A 71 PHE C C 13 174.315 0.3 A 71 PHE CA C 13 58.852 0.3 A 71 PHE CB C 13 42.713 0.3 A 71 PHE CD1 C 13 133.299 0.3 A 71 PHE CD2 C 13 133.299 0.3 A 71 PHE CE1 C 13 133.299 0.3 A 71 PHE CE2 C 13 133.299 0.3 A 71 PHE N N 15 129.107 0.3 A 72 GLU H H 1 8.134 0.020 A 72 GLU HA H 1 5.151 0.020 A 72 GLU HBy H 1 1.988 0.020 A 72 GLU HBx H 1 1.759 0.020 A 72 GLU HG2 H 1 2.163 0.020 A 72 GLU HG3 H 1 2.163 0.020 A 72 GLU C C 13 175.090 0.3 A 72 GLU CA C 13 54.732 0.3 A 72 GLU CB C 13 31.840 0.3 A 72 GLU CG C 13 37.105 0.3 A 72 GLU N N 15 126.483 0.3 A 73 TYR H H 1 8.504 0.020 A 73 TYR HA H 1 4.675 0.020 A 73 TYR HBy H 1 2.951 0.020 A 73 TYR HBx H 1 2.875 0.020 A 73 TYR HD1 H 1 6.874 0.020 A 73 TYR HD2 H 1 6.874 0.020 A 73 TYR HE1 H 1 6.476 0.020 A 73 TYR HE2 H 1 6.476 0.020 A 73 TYR C C 13 172.966 0.3 A 73 TYR CA C 13 55.991 0.3 A 73 TYR CB C 13 39.509 0.3 A 73 TYR CD1 C 13 133.733 0.3 A 73 TYR CD2 C 13 133.733 0.3 A 73 TYR CE1 C 13 117.457 0.3 A 73 TYR CE2 C 13 117.457 0.3 A 73 TYR N N 15 120.527 0.3 A 74 MET H H 1 8.752 0.020 A 74 MET HA H 1 4.729 0.020 A 74 MET HB2 H 1 1.832 0.020 A 74 MET HB3 H 1 1.832 0.020 A 74 MET HG2 H 1 2.388 0.020 A 74 MET HG3 H 1 2.388 0.020 A 74 MET C C 13 176.000 0.3 A 74 MET CA C 13 53.930 0.3 A 74 MET CB C 13 32.412 0.3 A 74 MET CG C 13 31.840 0.3 A 74 MET N N 15 118.604 0.3 A 75 HIS H H 1 8.902 0.020 A 75 HIS HA H 1 4.675 0.020 A 75 HIS HBy H 1 2.945 0.020 A 75 HIS HBx H 1 2.750 0.020 A 75 HIS HD2 H 1 6.884 0.020 A 75 HIS C C 13 174.112 0.3 A 75 HIS CA C 13 55.762 0.3 A 75 HIS CB C 13 32.755 0.3 A 75 HIS CD2 C 13 118.937 0.3 A 75 HIS N N 15 123.810 0.3 A 76 GLN H H 1 8.292 0.020 A 76 GLN HA H 1 4.296 0.020 A 76 GLN HBy H 1 1.832 0.020 A 76 GLN HBx H 1 1.731 0.020 A 76 GLN HGy H 1 2.070 0.020 A 76 GLN HGx H 1 2.009 0.020 A 76 GLN C C 13 175.056 0.3 A 76 GLN CA C 13 55.189 0.3 A 76 GLN CB C 13 29.551 0.3 A 76 GLN CG C 13 33.557 0.3 A 76 GLN N N 15 125.324 0.3 A 77 CYS H H 1 8.420 0.020 A 77 CYS HA H 1 4.296 0.020 A 77 CYS HBy H 1 2.786 0.020 A 77 CYS HBx H 1 2.724 0.020 A 77 CYS C C 13 174.719 0.3 A 77 CYS CA C 13 58.738 0.3 A 77 CYS CB C 13 27.948 0.3 A 77 CYS N N 15 123.013 0.3 A 78 GLN H H 1 8.658 0.020 A 78 GLN HA H 1 4.100 0.020 A 78 GLN HB2 H 1 1.955 0.020 A 78 GLN HB3 H 1 1.955 0.020 A 78 GLN HGy H 1 2.265 0.020 A 78 GLN HGx H 1 2.264 0.020 A 78 GLN C C 13 176.910 0.3 A 78 GLN CA C 13 57.021 0.3 A 78 GLN CB C 13 28.635 0.3 A 78 GLN CG C 13 33.671 0.3 A 78 GLN N N 15 123.960 0.3 A 79 GLY H H 1 8.636 0.020 A 79 GLY HAy H 1 3.994 0.020 A 79 GLY HAx H 1 3.718 0.020 A 79 GLY C C 13 174.315 0.3 A 79 GLY CA C 13 45.460 0.3 A 79 GLY N N 15 111.173 0.3 A 80 THR H H 1 7.730 0.020 A 80 THR HA H 1 4.483 0.020 A 80 THR HB H 1 4.234 0.020 A 80 THR HG2% H 1 1.046 0.020 A 80 THR C C 13 174.483 0.3 A 80 THR CA C 13 60.912 0.3 A 80 THR CB C 13 70.413 0.3 A 80 THR CG2 C 13 21.310 0.3 A 80 THR N N 15 111.761 0.3 A 81 SER H H 1 8.312 0.020 A 81 SER HA H 1 3.810 0.020 A 81 SER HB2 H 1 3.718 0.020 A 81 SER HB3 H 1 3.718 0.020 A 81 SER C C 13 174.517 0.3 A 81 SER CA C 13 58.738 0.3 A 81 SER CB C 13 63.545 0.3 A 81 SER N N 15 116.277 0.3 A 82 GLU H H 1 8.058 0.020 A 82 GLU HA H 1 4.249 0.020 A 82 GLU HBy H 1 1.925 0.020 A 82 GLU HBx H 1 1.819 0.020 A 82 GLU HG2 H 1 2.121 0.020 A 82 GLU HG3 H 1 2.121 0.020 A 82 GLU C C 13 176.202 0.3 A 82 GLU CA C 13 56.449 0.3 A 82 GLU CB C 13 30.695 0.3 A 82 GLU CG C 13 36.075 0.3 A 82 GLU N N 15 121.911 0.3 A 83 SER H H 1 8.355 0.020 A 83 SER HA H 1 4.292 0.020 A 83 SER HB2 H 1 3.641 0.020 A 83 SER HB3 H 1 3.641 0.020 A 83 SER C C 13 174.146 0.3 A 83 SER CA C 13 58.165 0.3 A 83 SER CB C 13 64.461 0.3 A 83 SER N N 15 117.340 0.3 A 84 SER H H 1 8.435 0.020 A 84 SER HA H 1 4.734 0.020 A 84 SER HBx H 1 3.638 0.020 A 84 SER HBy H 1 3.671 0.020 A 84 SER C C 13 173.236 0.3 A 84 SER CA C 13 57.708 0.3 A 84 SER CB C 13 64.919 0.3 A 84 SER N N 15 117.340 0.3 A 85 LYS H H 1 8.274 0.020 A 85 LYS HA H 1 4.455 0.020 A 85 LYS HB2 H 1 1.589 0.020 A 85 LYS HB3 H 1 1.589 0.020 A 85 LYS HD2 H 1 1.483 0.020 A 85 LYS HD3 H 1 1.483 0.020 A 85 LYS HE2 H 1 2.767 0.020 A 85 LYS HE3 H 1 2.767 0.020 A 85 LYS HG2 H 1 1.190 0.020 A 85 LYS HG3 H 1 1.190 0.020 A 85 LYS C C 13 176.236 0.3 A 85 LYS CA C 13 56.677 0.3 A 85 LYS CB C 13 32.755 0.3 A 85 LYS CD C 13 28.978 0.3 A 85 LYS CE C 13 41.912 0.3 A 85 LYS CG C 13 24.972 0.3 A 85 LYS N N 15 123.283 0.3 A 86 LYS H H 1 8.590 0.020 A 86 LYS HA H 1 4.305 0.020 A 86 LYS HB2 H 1 1.648 0.020 A 86 LYS HB3 H 1 1.648 0.020 A 86 LYS HDy H 1 1.253 0.020 A 86 LYS HDx H 1 1.057 0.020 A 86 LYS HE2 H 1 2.738 0.020 A 86 LYS HE3 H 1 2.738 0.020 A 86 LYS HG2 H 1 0.648 0.020 A 86 LYS HG3 H 1 0.648 0.020 A 86 LYS C C 13 174.753 0.3 A 86 LYS CA C 13 54.388 0.3 A 86 LYS CB C 13 34.358 0.3 A 86 LYS CD C 13 24.858 0.3 A 86 LYS CE C 13 42.027 0.3 A 86 LYS CG C 13 22.683 0.3 A 86 LYS N N 15 125.176 0.3 A 87 GLN H H 1 7.946 0.020 A 87 GLN HA H 1 5.169 0.020 A 87 GLN HB2 H 1 1.843 0.020 A 87 GLN HB3 H 1 1.843 0.020 A 87 GLN HG2 H 1 2.107 0.020 A 87 GLN HG3 H 1 2.107 0.020 A 87 GLN C C 13 175.562 0.3 A 87 GLN CA C 13 54.617 0.3 A 87 GLN CB C 13 30.695 0.3 A 87 GLN CG C 13 33.557 0.3 A 87 GLN N N 15 118.903 0.3 A 88 LYS H H 1 9.258 0.020 A 88 LYS HA H 1 4.638 0.020 A 88 LYS HB2 H 1 2.448 0.020 A 88 LYS HB3 H 1 2.448 0.020 A 88 LYS HDy H 1 1.869 0.020 A 88 LYS HDx H 1 1.743 0.020 A 88 LYS HG2 H 1 1.440 0.020 A 88 LYS HG3 H 1 1.440 0.020 A 88 LYS C C 13 174.449 0.3 A 88 LYS CA C 13 55.418 0.3 A 88 LYS CB C 13 36.876 0.3 A 88 LYS CD C 13 30.008 0.3 A 88 LYS CG C 13 25.316 0.3 A 88 LYS N N 15 124.114 0.3 A 89 LEU H H 1 8.318 0.020 A 89 LEU HA H 1 5.120 0.020 A 89 LEU HB2 H 1 1.749 0.020 A 89 LEU HB3 H 1 1.749 0.020 A 89 LEU HD1% H 1 0.795 0.020 A 89 LEU HD2% H 1 0.795 0.020 A 89 LEU HG H 1 1.378 0.020 A 89 LEU C C 13 176.843 0.3 A 89 LEU CA C 13 54.617 0.3 A 89 LEU CB C 13 43.972 0.3 A 89 LEU CD1 C 13 24.743 0.3 A 89 LEU CD2 C 13 24.743 0.3 A 89 LEU CG C 13 25.888 0.3 A 89 LEU N N 15 123.968 0.3 A 90 PHE H H 1 8.465 0.020 A 90 PHE HA H 1 5.447 0.020 A 90 PHE HBy H 1 2.802 0.020 A 90 PHE HBx H 1 2.558 0.020 A 90 PHE HD1 H 1 6.793 0.020 A 90 PHE HD2 H 1 6.793 0.020 A 90 PHE HE1 H 1 6.793 0.020 A 90 PHE HE2 H 1 6.793 0.020 A 90 PHE C C 13 171.786 0.3 A 90 PHE CA C 13 55.189 0.3 A 90 PHE CB C 13 43.286 0.3 A 90 PHE CD1 C 13 133.189 0.3 A 90 PHE CD2 C 13 133.189 0.3 A 90 PHE CE1 C 13 133.189 0.3 A 90 PHE CE2 C 13 133.189 0.3 A 90 PHE N N 15 118.366 0.3 A 91 LEU H H 1 8.437 0.020 A 91 LEU HA H 1 5.505 0.020 A 91 LEU HB2 H 1 2.004 0.020 A 91 LEU HB3 H 1 2.004 0.020 A 91 LEU HDx% H 1 0.886 0.020 A 91 LEU HDy% H 1 0.732 0.020 A 91 LEU HG H 1 1.549 0.020 A 91 LEU C C 13 174.449 0.3 A 91 LEU CA C 13 52.900 0.3 A 91 LEU CB C 13 47.177 0.3 A 91 LEU CD1 C 13 23.942 0.3 A 91 LEU CD2 C 13 23.942 0.3 A 91 LEU CG C 13 25.545 0.3 A 91 LEU N N 15 121.719 0.3 A 92 MET H H 1 10.273 0.020 A 92 MET HA H 1 6.176 0.020 A 92 MET HB2 H 1 2.234 0.020 A 92 MET HB3 H 1 2.234 0.020 A 92 MET HG2 H 1 2.372 0.020 A 92 MET HG3 H 1 2.372 0.020 A 92 MET C C 13 176.169 0.3 A 92 MET CA C 13 53.015 0.3 A 92 MET CB C 13 39.623 0.3 A 92 MET CG C 13 31.496 0.3 A 92 MET N N 15 126.389 0.3 A 93 SER H H 1 9.038 0.020 A 93 SER HA H 1 4.885 0.020 A 93 SER HBy H 1 3.079 0.020 A 93 SER HBx H 1 2.840 0.020 A 93 SER C C 13 172.225 0.3 A 93 SER CA C 13 56.563 0.3 A 93 SER CB C 13 63.545 0.3 A 93 SER N N 15 120.841 0.3 A 94 TRP H H 1 9.001 0.020 A 94 TRP HA H 1 5.147 0.020 A 94 TRP HB2 H 1 2.894 0.020 A 94 TRP HB3 H 1 2.894 0.020 A 94 TRP C C 13 173.270 0.3 A 94 TRP CA C 13 54.961 0.3 A 94 TRP CB C 13 30.695 0.3 A 94 TRP N N 15 129.918 0.3 A 95 CYS H H 1 7.319 0.020 A 95 CYS HA H 1 4.821 0.020 A 95 CYS HBy H 1 2.529 0.020 A 95 CYS HBx H 1 2.199 0.020 A 95 CYS CA C 13 53.813 0.3 A 95 CYS N N 15 122.538 0.3 A 96 PRO HA H 1 3.819 0.020 A 96 PRO HB2 H 1 1.605 0.020 A 96 PRO HB3 H 1 1.605 0.020 A 96 PRO HG2 H 1 1.312 0.020 A 96 PRO HG3 H 1 1.312 0.020 A 96 PRO C C 13 177.888 0.3 A 96 PRO CA C 13 61.828 0.3 A 96 PRO CB C 13 31.840 0.3 A 96 PRO CD C 13 26.918 0.3 A 96 PRO CG C 13 24.858 0.3 A 97 ASP H H 1 8.040 0.020 A 97 ASP HA H 1 4.058 0.020 A 97 ASP HB2 H 1 2.526 0.020 A 97 ASP HB3 H 1 2.526 0.020 A 97 ASP C C 13 176.809 0.3 A 97 ASP CA C 13 56.906 0.3 A 97 ASP CB C 13 40.882 0.3 A 97 ASP N N 15 118.960 0.3 A 98 THR H H 1 6.917 0.020 A 98 THR HA H 1 3.856 0.020 A 98 THR HB H 1 4.161 0.020 A 98 THR HG2% H 1 1.112 0.020 A 98 THR C C 13 174.921 0.3 A 98 THR CA C 13 61.599 0.3 A 98 THR CB C 13 68.925 0.3 A 98 THR CG2 C 13 21.767 0.3 A 98 THR N N 15 104.267 0.3 A 99 ALA H H 1 7.496 0.020 A 99 ALA HA H 1 4.016 0.020 A 99 ALA HB% H 1 0.841 0.020 A 99 ALA C C 13 177.045 0.3 A 99 ALA CA C 13 52.099 0.3 A 99 ALA CB C 13 19.020 0.3 A 99 ALA N N 15 125.807 0.3 A 100 LYS H H 1 8.271 0.020 A 100 LYS HA H 1 4.085 0.020 A 100 LYS HB2 H 1 1.993 0.020 A 100 LYS HB3 H 1 1.993 0.020 A 100 LYS HD2 H 1 1.618 0.020 A 100 LYS HD3 H 1 1.618 0.020 A 100 LYS HE2 H 1 3.024 0.020 A 100 LYS HE3 H 1 3.024 0.020 A 100 LYS HGy H 1 1.177 0.020 A 100 LYS HGx H 1 0.868 0.020 A 100 LYS C C 13 178.832 0.3 A 100 LYS CA C 13 56.334 0.3 A 100 LYS CB C 13 32.527 0.3 A 100 LYS CD C 13 28.864 0.3 A 100 LYS CE C 13 43.515 0.3 A 100 LYS CG C 13 25.659 0.3 A 100 LYS N N 15 119.465 0.3 A 101 VAL H H 1 8.518 0.020 A 101 VAL HA H 1 3.397 0.020 A 101 VAL HB H 1 1.974 0.020 A 101 VAL HGx% H 1 0.993 0.020 A 101 VAL HGy% H 1 0.886 0.020 A 101 VAL C C 13 177.584 0.3 A 101 VAL CA C 13 66.979 0.3 A 101 VAL CB C 13 31.496 0.3 A 101 VAL CG1 C 13 22.225 0.3 A 101 VAL CG2 C 13 20.508 0.3 A 101 VAL N N 15 123.351 0.3 A 102 LYS H H 1 8.558 0.020 A 102 LYS HA H 1 3.931 0.020 A 102 LYS HB2 H 1 1.756 0.020 A 102 LYS HB3 H 1 1.756 0.020 A 102 LYS HD2 H 1 1.606 0.020 A 102 LYS HD3 H 1 1.606 0.020 A 102 LYS HE2 H 1 2.866 0.020 A 102 LYS HE3 H 1 2.866 0.020 A 102 LYS HG2 H 1 1.328 0.020 A 102 LYS HG3 H 1 1.328 0.020 A 102 LYS C C 13 179.540 0.3 A 102 LYS CA C 13 59.882 0.3 A 102 LYS CB C 13 32.298 0.3 A 102 LYS CD C 13 29.207 0.3 A 102 LYS CE C 13 42.027 0.3 A 102 LYS CG C 13 25.430 0.3 A 102 LYS N N 15 118.249 0.3 A 103 LYS H H 1 6.854 0.020 A 103 LYS HA H 1 4.118 0.020 A 103 LYS HB2 H 1 1.972 0.020 A 103 LYS HB3 H 1 1.972 0.020 A 103 LYS HD2 H 1 1.803 0.020 A 103 LYS HD3 H 1 1.803 0.020 A 103 LYS HE2 H 1 2.951 0.020 A 103 LYS HE3 H 1 2.951 0.020 A 103 LYS HG2 H 1 1.606 0.020 A 103 LYS HG3 H 1 1.606 0.020 A 103 LYS C C 13 177.921 0.3 A 103 LYS CA C 13 58.394 0.3 A 103 LYS CB C 13 31.840 0.3 A 103 LYS CD C 13 28.520 0.3 A 103 LYS CE C 13 38.707 0.3 A 103 LYS CG C 13 24.972 0.3 A 103 LYS N N 15 118.668 0.3 A 104 LYS H H 1 8.048 0.020 A 104 LYS HA H 1 3.894 0.020 A 104 LYS HB2 H 1 2.142 0.020 A 104 LYS HB3 H 1 2.142 0.020 A 104 LYS HDy H 1 1.756 0.020 A 104 LYS HDx H 1 1.566 0.020 A 104 LYS HE2 H 1 2.932 0.020 A 104 LYS HE3 H 1 2.932 0.020 A 104 LYS HG2 H 1 1.366 0.020 A 104 LYS HG3 H 1 1.366 0.020 A 104 LYS C C 13 180.011 0.3 A 104 LYS CA C 13 60.684 0.3 A 104 LYS CB C 13 31.725 0.3 A 104 LYS CD C 13 29.551 0.3 A 104 LYS CE C 13 42.942 0.3 A 104 LYS CG C 13 26.117 0.3 A 104 LYS N N 15 119.199 0.3 A 105 MET H H 1 8.546 0.020 A 105 MET HA H 1 4.121 0.020 A 105 MET HB2 H 1 2.014 0.020 A 105 MET HB3 H 1 2.014 0.020 A 105 MET HG2 H 1 2.633 0.020 A 105 MET HG3 H 1 2.633 0.020 A 105 MET C C 13 178.899 0.3 A 105 MET CA C 13 58.509 0.3 A 105 MET CB C 13 32.069 0.3 A 105 MET CG C 13 32.069 0.3 A 105 MET N N 15 118.021 0.3 A 106 LEU H H 1 7.674 0.020 A 106 LEU HA H 1 4.036 0.020 A 106 LEU HBx H 1 1.605 0.020 A 106 LEU HBy H 1 1.627 0.020 A 106 LEU HDx% H 1 0.738 0.020 A 106 LEU HDy% H 1 0.644 0.020 A 106 LEU HG H 1 1.627 0.020 A 106 LEU C C 13 179.910 0.3 A 106 LEU CA C 13 58.165 0.3 A 106 LEU CB C 13 41.912 0.3 A 106 LEU CD1 C 13 22.683 0.3 A 106 LEU CD2 C 13 22.683 0.3 A 106 LEU CG C 13 26.231 0.3 A 106 LEU N N 15 122.895 0.3 A 107 TYR H H 1 8.669 0.020 A 107 TYR HA H 1 4.034 0.020 A 107 TYR HBy H 1 2.870 0.020 A 107 TYR HBx H 1 2.320 0.020 A 107 TYR HD1 H 1 6.751 0.020 A 107 TYR HD2 H 1 6.751 0.020 A 107 TYR HE1 H 1 6.362 0.020 A 107 TYR HE2 H 1 6.362 0.020 A 107 TYR C C 13 181.360 0.3 A 107 TYR CA C 13 60.912 0.3 A 107 TYR CB C 13 37.677 0.3 A 107 TYR CE1 C 13 117.784 0.3 A 107 TYR CE2 C 13 117.784 0.3 A 107 TYR N N 15 119.036 0.3 A 108 SER H H 1 8.973 0.020 A 108 SER HA H 1 4.324 0.020 A 108 SER HB2 H 1 3.924 0.020 A 108 SER HB3 H 1 3.924 0.020 A 108 SER C C 13 178.023 0.3 A 108 SER CA C 13 62.286 0.3 A 108 SER CB C 13 63.545 0.3 A 108 SER N N 15 118.372 0.3 A 109 SER H H 1 8.353 0.020 A 109 SER HA H 1 4.292 0.020 A 109 SER HBx H 1 3.930 0.020 A 109 SER HBy H 1 3.930 0.020 A 109 SER C C 13 176.405 0.3 A 109 SER CA C 13 61.370 0.3 A 109 SER CB C 13 63.202 0.3 A 109 SER N N 15 116.727 0.3 A 110 SER H H 1 7.236 0.020 A 110 SER HA H 1 4.549 0.020 A 110 SER HBy H 1 3.930 0.020 A 110 SER HBx H 1 3.608 0.020 A 110 SER C C 13 172.899 0.3 A 110 SER CA C 13 59.424 0.3 A 110 SER CB C 13 62.973 0.3 A 110 SER N N 15 115.229 0.3 A 111 PHE H H 1 7.069 0.020 A 111 PHE HA H 1 4.015 0.020 A 111 PHE HBy H 1 3.504 0.020 A 111 PHE HBx H 1 3.133 0.020 A 111 PHE HD1 H 1 6.969 0.020 A 111 PHE HD2 H 1 6.969 0.020 A 111 PHE HE1 H 1 6.969 0.020 A 111 PHE HE2 H 1 6.969 0.020 A 111 PHE C C 13 177.483 0.3 A 111 PHE CA C 13 57.708 0.3 A 111 PHE CB C 13 38.364 0.3 A 111 PHE CD1 C 13 133.411 0.3 A 111 PHE CD2 C 13 133.411 0.3 A 111 PHE CE1 C 13 133.411 0.3 A 111 PHE CE2 C 13 133.411 0.3 A 111 PHE N N 15 120.978 0.3 A 112 ASP H H 1 8.305 0.020 A 112 ASP HA H 1 3.753 0.020 A 112 ASP HBy H 1 2.442 0.020 A 112 ASP HBx H 1 2.283 0.020 A 112 ASP C C 13 177.281 0.3 A 112 ASP CA C 13 57.479 0.3 A 112 ASP CB C 13 40.424 0.3 A 112 ASP N N 15 116.485 0.3 A 113 ALA H H 1 7.393 0.020 A 113 ALA HA H 1 3.753 0.020 A 113 ALA HB% H 1 1.140 0.020 A 113 ALA C C 13 180.416 0.3 A 113 ALA CA C 13 54.846 0.3 A 113 ALA CB C 13 17.075 0.3 A 113 ALA N N 15 121.059 0.3 A 114 LEU H H 1 6.647 0.020 A 114 LEU HA H 1 3.632 0.020 A 114 LEU HB2 H 1 1.448 0.020 A 114 LEU HB3 H 1 1.448 0.020 A 114 LEU HDx% H 1 0.575 0.020 A 114 LEU HDy% H 1 0.017 0.020 A 114 LEU HG H 1 1.134 0.020 A 114 LEU C C 13 178.191 0.3 A 114 LEU CA C 13 56.906 0.3 A 114 LEU CB C 13 41.340 0.3 A 114 LEU CD1 C 13 21.767 0.3 A 114 LEU CD2 C 13 21.767 0.3 A 114 LEU CG C 13 26.689 0.3 A 114 LEU N N 15 118.535 0.3 A 115 LYS H H 1 7.730 0.020 A 115 LYS HA H 1 3.229 0.020 A 115 LYS HB2 H 1 1.571 0.020 A 115 LYS HB3 H 1 1.571 0.020 A 115 LYS HD2 H 1 1.300 0.020 A 115 LYS HD3 H 1 1.300 0.020 A 115 LYS HE2 H 1 2.951 0.020 A 115 LYS HE3 H 1 2.951 0.020 A 115 LYS HG2 H 1 1.127 0.020 A 115 LYS HG3 H 1 1.127 0.020 A 115 LYS C C 13 179.877 0.3 A 115 LYS CA C 13 59.424 0.3 A 115 LYS CB C 13 31.954 0.3 A 115 LYS CD C 13 29.322 0.3 A 115 LYS CE C 13 43.400 0.3 A 115 LYS CG C 13 24.514 0.3 A 115 LYS N N 15 117.340 0.3 A 116 LYS H H 1 7.714 0.020 A 116 LYS HA H 1 3.700 0.020 A 116 LYS HB2 H 1 1.580 0.020 A 116 LYS HB3 H 1 1.580 0.020 A 116 LYS HD2 H 1 1.334 0.020 A 116 LYS HD3 H 1 1.334 0.020 A 116 LYS HE2 H 1 2.762 0.020 A 116 LYS HE3 H 1 2.762 0.020 A 116 LYS HG2 H 1 1.184 0.020 A 116 LYS HG3 H 1 1.184 0.020 A 116 LYS C C 13 177.652 0.3 A 116 LYS CA C 13 58.394 0.3 A 116 LYS CB C 13 32.527 0.3 A 116 LYS CD C 13 28.864 0.3 A 116 LYS CE C 13 42.141 0.3 A 116 LYS CG C 13 25.545 0.3 A 116 LYS N N 15 116.144 0.3 A 117 SER H H 1 6.957 0.020 A 117 SER HA H 1 4.179 0.020 A 117 SER HB2 H 1 3.547 0.020 A 117 SER HB3 H 1 3.547 0.020 A 117 SER C C 13 174.483 0.3 A 117 SER CA C 13 60.912 0.3 A 117 SER CB C 13 64.232 0.3 A 117 SER N N 15 111.789 0.3 A 118 LEU H H 1 6.997 0.020 A 118 LEU HA H 1 3.922 0.020 A 118 LEU HB2 H 1 1.290 0.020 A 118 LEU HB3 H 1 1.290 0.020 A 118 LEU HDx% H 1 0.383 0.020 A 118 LEU HDy% H 1 0.138 0.020 A 118 LEU HG H 1 0.886 0.020 A 118 LEU C C 13 175.730 0.3 A 118 LEU CA C 13 52.214 0.3 A 118 LEU CB C 13 37.448 0.3 A 118 LEU CD1 C 13 21.538 0.3 A 118 LEU CD2 C 13 21.538 0.3 A 118 LEU CG C 13 26.460 0.3 A 118 LEU N N 15 122.293 0.3 A 119 VAL H H 1 7.347 0.020 A 119 VAL HA H 1 3.627 0.020 A 119 VAL HB H 1 1.968 0.020 A 119 VAL HGx% H 1 0.929 0.020 A 119 VAL HGy% H 1 0.868 0.020 A 119 VAL C C 13 178.697 0.3 A 119 VAL CA C 13 64.919 0.3 A 119 VAL CB C 13 31.382 0.3 A 119 VAL CG1 C 13 21.538 0.3 A 119 VAL CG2 C 13 20.623 0.3 A 119 VAL N N 15 121.059 0.3 A 120 GLY H H 1 9.077 0.020 A 120 GLY HAy H 1 4.249 0.020 A 120 GLY HAx H 1 3.700 0.020 A 120 GLY C C 13 174.517 0.3 A 120 GLY CA C 13 44.888 0.3 A 120 GLY N N 15 117.377 0.3 A 121 VAL H H 1 7.316 0.020 A 121 VAL HA H 1 3.762 0.020 A 121 VAL HB H 1 1.970 0.020 A 121 VAL HG1% H 1 0.780 0.020 A 121 VAL HG2% H 1 0.780 0.020 A 121 VAL C C 13 175.966 0.3 A 121 VAL CA C 13 64.117 0.3 A 121 VAL CB C 13 31.611 0.3 A 121 VAL CG1 C 13 22.797 0.3 A 121 VAL CG2 C 13 22.797 0.3 A 121 VAL N N 15 122.254 0.3 A 122 GLN H H 1 8.678 0.020 A 122 GLN HA H 1 4.253 0.020 A 122 GLN HBy H 1 2.142 0.020 A 122 GLN HBx H 1 1.831 0.020 A 122 GLN HG2 H 1 2.293 0.020 A 122 GLN HG3 H 1 2.293 0.020 A 122 GLN C C 13 174.854 0.3 A 122 GLN CA C 13 56.105 0.3 A 122 GLN CB C 13 31.039 0.3 A 122 GLN CG C 13 34.358 0.3 A 122 GLN N N 15 123.484 0.3 A 123 LYS H H 1 6.726 0.020 A 123 LYS HA H 1 4.310 0.020 A 123 LYS HB2 H 1 1.759 0.020 A 123 LYS HB3 H 1 1.759 0.020 A 123 LYS HDx H 1 1.416 0.020 A 123 LYS HDy H 1 1.416 0.020 A 123 LYS HE2 H 1 2.844 0.020 A 123 LYS HE3 H 1 2.844 0.020 A 123 LYS HG2 H 1 1.178 0.020 A 123 LYS HG3 H 1 1.178 0.020 A 123 LYS C C 13 173.000 0.3 A 123 LYS CA C 13 53.358 0.3 A 123 LYS CB C 13 34.816 0.3 A 123 LYS CD C 13 28.177 0.3 A 123 LYS CE C 13 43.515 0.3 A 123 LYS CG C 13 24.057 0.3 A 123 LYS N N 15 117.871 0.3 A 124 TYR H H 1 8.441 0.020 A 124 TYR HA H 1 5.899 0.020 A 124 TYR HBy H 1 2.989 0.020 A 124 TYR HBx H 1 2.813 0.020 A 124 TYR HD1 H 1 6.971 0.020 A 124 TYR HD2 H 1 6.971 0.020 A 124 TYR HE1 H 1 6.531 0.020 A 124 TYR HE2 H 1 6.531 0.020 A 124 TYR C C 13 175.663 0.3 A 124 TYR CA C 13 54.846 0.3 A 124 TYR CB C 13 40.424 0.3 A 124 TYR CD1 C 13 130.219 0.3 A 124 TYR CD2 C 13 130.219 0.3 A 124 TYR N N 15 123.352 0.3 A 125 ILE H H 1 9.123 0.020 A 125 ILE HA H 1 4.402 0.020 A 125 ILE HB H 1 1.606 0.020 A 125 ILE HD1% H 1 0.285 0.020 A 125 ILE HG12 H 1 1.152 0.020 A 125 ILE HG13 H 1 1.152 0.020 A 125 ILE HG2% H 1 0.739 0.020 A 125 ILE C C 13 174.348 0.3 A 125 ILE CA C 13 59.882 0.3 A 125 ILE CB C 13 42.256 0.3 A 125 ILE CD1 C 13 13.183 0.3 A 125 ILE CG1 C 13 27.490 0.3 A 125 ILE CG2 C 13 17.189 0.3 A 125 ILE N N 15 122.835 0.3 A 126 GLN H H 1 8.916 0.020 A 126 GLN HA H 1 4.877 0.020 A 126 GLN HB2 H 1 1.924 0.020 A 126 GLN HB3 H 1 1.924 0.020 A 126 GLN HG2 H 1 2.184 0.020 A 126 GLN HG3 H 1 2.184 0.020 A 126 GLN C C 13 174.146 0.3 A 126 GLN CA C 13 55.075 0.3 A 126 GLN CB C 13 29.551 0.3 A 126 GLN CG C 13 34.358 0.3 A 126 GLN N N 15 126.869 0.3 A 127 ALA H H 1 8.829 0.020 A 127 ALA HA H 1 4.963 0.020 A 127 ALA HB% H 1 1.507 0.020 A 127 ALA C C 13 176.539 0.3 A 127 ALA CA C 13 50.954 0.3 A 127 ALA CB C 13 21.882 0.3 A 127 ALA N N 15 127.414 0.3 A 128 THR H H 1 9.350 0.020 A 128 THR HA H 1 3.994 0.020 A 128 THR HB H 1 4.079 0.020 A 128 THR HG2% H 1 0.925 0.020 A 128 THR C C 13 172.933 0.3 A 128 THR CA C 13 60.912 0.3 A 128 THR CB C 13 70.527 0.3 A 128 THR CG2 C 13 21.195 0.3 A 128 THR N N 15 112.753 0.3 A 129 ASP H H 1 7.602 0.020 A 129 ASP HA H 1 4.578 0.020 A 129 ASP HBy H 1 2.844 0.020 A 129 ASP HBx H 1 2.610 0.020 A 129 ASP C C 13 176.573 0.3 A 129 ASP CA C 13 53.015 0.3 A 129 ASP CB C 13 43.744 0.3 A 129 ASP N N 15 118.551 0.3 A 130 LEU H H 1 8.910 0.020 A 130 LEU HA H 1 3.977 0.020 A 130 LEU HB2 H 1 1.636 0.020 A 130 LEU HB3 H 1 1.636 0.020 A 130 LEU HDx% H 1 0.647 0.020 A 130 LEU HDy% H 1 0.533 0.020 A 130 LEU HG H 1 1.540 0.020 A 130 LEU C C 13 179.202 0.3 A 130 LEU CA C 13 58.051 0.3 A 130 LEU CB C 13 41.569 0.3 A 130 LEU CD1 C 13 23.713 0.3 A 130 LEU CD2 C 13 23.713 0.3 A 130 LEU CG C 13 27.147 0.3 A 130 LEU N N 15 122.387 0.3 A 131 SER H H 1 8.645 0.020 A 131 SER HA H 1 3.856 0.020 A 131 SER HB2 H 1 4.121 0.020 A 131 SER HB3 H 1 4.121 0.020 A 131 SER C C 13 177.180 0.3 A 131 SER CA C 13 62.515 0.3 A 131 SER CB C 13 68.352 0.3 A 131 SER N N 15 116.410 0.3 A 132 GLU H H 1 7.749 0.020 A 132 GLU HA H 1 4.070 0.020 A 132 GLU HB2 H 1 2.158 0.020 A 132 GLU HB3 H 1 2.158 0.020 A 132 GLU HG2 H 1 2.401 0.020 A 132 GLU HG3 H 1 2.401 0.020 A 132 GLU C C 13 175.427 0.3 A 132 GLU CA C 13 57.021 0.3 A 132 GLU CB C 13 31.039 0.3 A 132 GLU CG C 13 36.876 0.3 A 132 GLU N N 15 120.840 0.3 A 133 ALA H H 1 7.347 0.020 A 133 ALA HA H 1 4.351 0.020 A 133 ALA HB% H 1 1.132 0.020 A 133 ALA C C 13 175.730 0.3 A 133 ALA CA C 13 50.382 0.3 A 133 ALA CB C 13 20.279 0.3 A 133 ALA N N 15 117.182 0.3 A 134 SER H H 1 7.061 0.020 A 134 SER HA H 1 4.185 0.020 A 134 SER HB2 H 1 3.951 0.020 A 134 SER HB3 H 1 3.951 0.020 A 134 SER C C 13 173.067 0.3 A 134 SER CA C 13 58.509 0.3 A 134 SER CB C 13 64.690 0.3 A 134 SER N N 15 115.197 0.3 A 135 ARG H H 1 8.961 0.020 A 135 ARG HA H 1 4.185 0.020 A 135 ARG HBy H 1 1.566 0.020 A 135 ARG HBx H 1 1.565 0.020 A 135 ARG HD2 H 1 3.018 0.020 A 135 ARG HD3 H 1 3.018 0.020 A 135 ARG HG2 H 1 1.463 0.020 A 135 ARG HG3 H 1 1.463 0.020 A 135 ARG C C 13 177.888 0.3 A 135 ARG CA C 13 60.111 0.3 A 135 ARG CB C 13 29.551 0.3 A 135 ARG CD C 13 43.286 0.3 A 135 ARG CG C 13 27.261 0.3 A 135 ARG N N 15 122.190 0.3 A 136 GLU H H 1 8.588 0.020 A 136 GLU HA H 1 3.795 0.020 A 136 GLU HBy H 1 1.894 0.020 A 136 GLU HBx H 1 1.803 0.020 A 136 GLU HGy H 1 2.264 0.020 A 136 GLU HGx H 1 2.123 0.020 A 136 GLU C C 13 178.865 0.3 A 136 GLU CA C 13 59.997 0.3 A 136 GLU CB C 13 28.749 0.3 A 136 GLU CG C 13 36.990 0.3 A 136 GLU N N 15 115.480 0.3 A 137 ALA H H 1 7.578 0.020 A 137 ALA HA H 1 3.922 0.020 A 137 ALA HB% H 1 1.269 0.020 A 137 ALA C C 13 181.191 0.3 A 137 ALA CA C 13 54.846 0.3 A 137 ALA CB C 13 18.334 0.3 A 137 ALA N N 15 123.947 0.3 A 138 VAL H H 1 8.108 0.020 A 138 VAL HA H 1 3.905 0.020 A 138 VAL HB H 1 2.014 0.020 A 138 VAL HGx% H 1 1.163 0.020 A 138 VAL HGy% H 1 0.886 0.020 A 138 VAL C C 13 177.584 0.3 A 138 VAL CA C 13 66.635 0.3 A 138 VAL CB C 13 31.039 0.3 A 138 VAL CG1 C 13 22.225 0.3 A 138 VAL CG2 C 13 20.508 0.3 A 138 VAL N N 15 119.326 0.3 A 139 GLU H H 1 8.248 0.020 A 139 GLU HA H 1 4.071 0.020 A 139 GLU HBy H 1 1.988 0.020 A 139 GLU HBx H 1 1.766 0.020 A 139 GLU HGy H 1 3.016 0.020 A 139 GLU HGx H 1 2.972 0.020 A 139 GLU C C 13 178.157 0.3 A 139 GLU CA C 13 60.569 0.3 A 139 GLU CB C 13 29.093 0.3 A 139 GLU CG C 13 37.334 0.3 A 139 GLU N N 15 119.418 0.3 A 140 GLU H H 1 7.305 0.020 A 140 GLU HA H 1 3.731 0.020 A 140 GLU HB2 H 1 1.904 0.020 A 140 GLU HB3 H 1 1.904 0.020 A 140 GLU HG2 H 1 2.136 0.020 A 140 GLU HG3 H 1 2.136 0.020 A 140 GLU C C 13 179.202 0.3 A 140 GLU CA C 13 59.424 0.3 A 140 GLU CB C 13 29.093 0.3 A 140 GLU CG C 13 35.846 0.3 A 140 GLU N N 15 116.410 0.3 A 141 LYS H H 1 7.292 0.020 A 141 LYS HA H 1 3.930 0.020 A 141 LYS HB2 H 1 2.053 0.020 A 141 LYS HB3 H 1 2.053 0.020 A 141 LYS HD2 H 1 1.719 0.020 A 141 LYS HD3 H 1 1.719 0.020 A 141 LYS HE2 H 1 2.920 0.020 A 141 LYS HE3 H 1 2.920 0.020 A 141 LYS HG2 H 1 1.401 0.020 A 141 LYS HG3 H 1 1.401 0.020 A 141 LYS C C 13 179.607 0.3 A 141 LYS CA C 13 58.394 0.3 A 141 LYS CB C 13 32.183 0.3 A 141 LYS CD C 13 28.635 0.3 A 141 LYS CE C 13 40.997 0.3 A 141 LYS CG C 13 25.316 0.3 A 141 LYS N N 15 118.210 0.3 A 142 LEU H H 1 8.112 0.020 A 142 LEU HA H 1 3.680 0.020 A 142 LEU HBy H 1 1.354 0.020 A 142 LEU HBx H 1 1.166 0.020 A 142 LEU HDx% H 1 0.424 0.020 A 142 LEU HDy% H 1 0.184 0.020 A 142 LEU HG H 1 1.354 0.020 A 142 LEU C C 13 178.663 0.3 A 142 LEU CA C 13 57.364 0.3 A 142 LEU CB C 13 40.424 0.3 A 142 LEU CD1 C 13 22.683 0.3 A 142 LEU CD2 C 13 22.683 0.3 A 142 LEU CG C 13 26.002 0.3 A 142 LEU N N 15 119.472 0.3 A 143 ARG H H 1 7.832 0.020 A 143 ARG HA H 1 3.960 0.020 A 143 ARG HB2 H 1 1.589 0.020 A 143 ARG HB3 H 1 1.589 0.020 A 143 ARG HD2 H 1 2.951 0.020 A 143 ARG HD3 H 1 2.951 0.020 A 143 ARG HG2 H 1 1.312 0.020 A 143 ARG HG3 H 1 1.312 0.020 A 143 ARG C C 13 177.989 0.3 A 143 ARG CA C 13 58.051 0.3 A 143 ARG CB C 13 30.695 0.3 A 143 ARG CD C 13 43.515 0.3 A 143 ARG CG C 13 28.292 0.3 A 143 ARG N N 15 117.384 0.3 A 144 ALA H H 1 7.284 0.020 A 144 ALA HA H 1 4.081 0.020 A 144 ALA HB% H 1 1.367 0.020 A 144 ALA C C 13 178.697 0.3 A 144 ALA CA C 13 53.930 0.3 A 144 ALA CB C 13 18.791 0.3 A 144 ALA N N 15 121.192 0.3 A 145 THR H H 1 7.690 0.020 A 145 THR HA H 1 4.270 0.020 A 145 THR HB H 1 4.270 0.020 A 145 THR HG2% H 1 1.154 0.020 A 145 THR C C 13 174.787 0.3 A 145 THR CA C 13 61.828 0.3 A 145 THR CB C 13 68.925 0.3 A 145 THR CG2 C 13 21.767 0.3 A 145 THR N N 15 109.503 0.3 A 146 ASP H H 1 7.873 0.020 A 146 ASP HA H 1 4.544 0.020 A 146 ASP HB2 H 1 2.584 0.020 A 146 ASP HB3 H 1 2.584 0.020 A 146 ASP C C 13 176.000 0.3 A 146 ASP CA C 13 54.732 0.3 A 146 ASP CB C 13 41.111 0.3 A 146 ASP N N 15 122.786 0.3 A 147 ARG H H 1 8.048 0.020 A 147 ARG HA H 1 4.270 0.020 A 147 ARG HBy H 1 1.820 0.020 A 147 ARG HBx H 1 1.664 0.020 A 147 ARG HD2 H 1 3.115 0.020 A 147 ARG HD3 H 1 3.115 0.020 A 147 ARG HGx H 1 1.557 0.020 A 147 ARG HGy H 1 1.557 0.020 A 147 ARG C C 13 175.427 0.3 A 147 ARG CA C 13 56.105 0.3 A 147 ARG CB C 13 30.695 0.3 A 147 ARG CD C 13 43.400 0.3 A 147 ARG CG C 13 26.918 0.3 A 147 ARG N N 15 120.926 0.3 A 148 GLN H H 1 7.940 0.020 A 148 GLN HA H 1 4.050 0.020 A 148 GLN HBy H 1 2.015 0.020 A 148 GLN HBx H 1 1.832 0.020 A 148 GLN HG2 H 1 2.199 0.020 A 148 GLN HG3 H 1 2.199 0.020 A 148 GLN CA C 13 54.708 0.3 A 148 GLN N N 15 126.492 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 ALA H A 1 MET HA 1.0 0.0 6.5 2 2 A 1 MET HA A 35 LYS HE2 1.0 0.0 6.5 3 3 A 1 MET HA A 35 LYS HE3 1.0 0.0 6.5 4 4 A 1 MET HB2 A 105 MET HB2 1.0 0.0 6.5 5 5 A 1 MET HB2 A 105 MET HB3 1.0 0.0 5.5 6 6 A 2 ALA H A 1 MET HB2 1.0 0.0 6.5 7 7 A 105 MET HB2 A 1 MET HB3 1.0 0.0 6.5 8 8 A 1 MET HB3 A 105 MET HB3 1.0 0.0 5.5 9 9 A 2 ALA H A 1 MET HB3 1.0 0.0 6.5 10 10 A 2 ALA H A 1 MET HG2 1.0 0.0 6.5 11 11 A 2 ALA H A 1 MET HG3 1.0 0.0 6.5 12 12 A 1 MET HB2 A 105 MET HG3 1.0 0.0 5.5 13 12 A 1 MET HB3 A 105 MET HG3 1.0 0.0 5.5 14 12 A 105 MET HG2 A 1 MET HB3 1.0 0.0 5.5 15 12 A 1 MET HB2 A 105 MET HG2 1.0 0.0 5.5 16 13 A 1 MET HB2 A 107 TYR HBy 1.0 0.0 6.5 17 13 A 1 MET HB3 A 107 TYR HBy 1.0 0.0 6.5 18 13 A 107 TYR HBx A 1 MET HB3 1.0 0.0 6.5 19 13 A 1 MET HB2 A 107 TYR HBx 1.0 0.0 6.5 20 14 A 1 MET HG3 A 107 TYR HBy 1.0 0.0 6.5 21 14 A 1 MET HG2 A 107 TYR HBy 1.0 0.0 6.5 22 14 A 107 TYR HBx A 1 MET HG3 1.0 0.0 6.5 23 14 A 107 TYR HBx A 1 MET HG2 1.0 0.0 6.5 24 15 A 2 ALA H A 3 SER H 1.0 0.0 6.5 25 16 A 3 SER H A 2 ALA HA 1.0 0.0 5.5 26 17 A 3 SER H A 2 ALA HB% 1.0 0.0 6.5 27 18 A 3 SER H A 3 SER HBx 1.0 0.0 5.5 28 18 A 3 SER H A 3 SER HBy 1.0 0.0 5.5 29 19 A 3 SER H A 4 GLY H 1.0 0.0 6.5 30 20 A 4 GLY H A 3 SER HA 1.0 0.0 6.5 31 21 A 3 SER HA A 5 VAL H 1.0 0.0 6.5 32 22 A 3 SER HBy A 4 GLY H 1.0 0.0 5.5 33 23 A 4 GLY H A 3 SER HBx 1.0 0.0 5.5 34 24 A 3 SER HBy A 109 SER HBy 1.0 0.0 6.5 35 24 A 3 SER HBx A 109 SER HBy 1.0 0.0 6.5 36 24 A 109 SER HBx A 3 SER HBx 1.0 0.0 6.5 37 24 A 3 SER HBy A 109 SER HBx 1.0 0.0 6.5 38 25 A 4 GLY H A 3 SER HBx 1.0 0.0 5.0 39 25 A 3 SER HBy A 4 GLY H 1.0 0.0 5.0 40 26 A 4 GLY H A 4 GLY HAx 1.0 0.0 5.0 41 26 A 4 GLY H A 4 GLY HAy 1.0 0.0 5.0 42 27 A 4 GLY H A 5 VAL H 1.0 0.0 6.5 43 28 A 4 GLY HAx A 109 SER HBy 1.0 0.0 6.5 44 28 A 4 GLY HAy A 109 SER HBy 1.0 0.0 6.5 45 28 A 109 SER HBx A 4 GLY HAx 1.0 0.0 6.5 46 28 A 109 SER HBx A 4 GLY HAy 1.0 0.0 6.5 47 29 A 113 ALA H A 4 GLY HAx 1.0 0.0 6.5 48 29 A 4 GLY HAy A 113 ALA H 1.0 0.0 6.5 49 30 A 5 VAL H A 4 GLY HAx 1.0 0.0 5.5 50 30 A 5 VAL H A 4 GLY HAy 1.0 0.0 5.5 51 31 A 5 VAL H A 110 SER HA 1.0 0.0 6.5 52 32 A 5 VAL H A 110 SER HBx 1.0 0.0 6.5 53 32 A 5 VAL H A 110 SER HBy 1.0 0.0 6.5 54 33 A 5 VAL H A 113 ALA HB% 1.0 0.0 6.5 55 34 A 5 VAL H A 5 VAL HB 1.0 0.0 5.5 56 35 A 5 VAL H A 5 VAL HG1% 1.0 0.0 6.5 57 36 A 5 VAL H A 5 VAL HG2% 1.0 0.0 6.5 58 37 A 5 VAL H A 6 THR H 1.0 0.0 6.5 59 38 A 5 VAL HA A 110 SER HBx 1.0 0.0 6.5 60 38 A 110 SER HBy A 5 VAL HA 1.0 0.0 6.5 61 39 A 113 ALA HB% A 5 VAL HA 1.0 0.0 6.5 62 40 A 5 VAL HA A 36 GLN H 1.0 0.0 6.5 63 41 A 5 VAL HA A 36 GLN HA 1.0 0.0 6.5 64 42 A 6 THR H A 5 VAL HA 1.0 0.0 5.5 65 43 A 110 SER HA A 5 VAL HB 1.0 0.0 6.5 66 44 A 110 SER HBy A 5 VAL HB 1.0 0.0 6.5 67 45 A 5 VAL HB A 110 SER HBx 1.0 0.0 6.5 68 46 A 5 VAL HB A 110 SER HBx 1.0 0.0 5.5 69 46 A 110 SER HBy A 5 VAL HB 1.0 0.0 5.5 70 47 A 5 VAL HB A 6 THR H 1.0 0.0 6.5 71 48 A 110 SER H A 5 VAL HG1% 1.0 0.0 6.5 72 49 A 110 SER HA A 5 VAL HG1% 1.0 0.0 5.5 73 50 A 110 SER HBy A 5 VAL HG1% 1.0 0.0 6.5 74 51 A 5 VAL HG1% A 110 SER HBx 1.0 0.0 6.5 75 52 A 113 ALA HB% A 5 VAL HG1% 1.0 0.0 6.5 76 53 A 35 LYS HA A 5 VAL HG1% 1.0 0.0 6.5 77 54 A 36 GLN H A 5 VAL HG1% 1.0 0.0 6.5 78 55 A 36 GLN HA A 5 VAL HG1% 1.0 0.0 6.5 79 56 A 37 ILE HB A 5 VAL HG1% 1.0 0.0 6.5 80 57 A 37 ILE HG2% A 5 VAL HG1% 1.0 0.0 6.5 81 58 A 6 THR H A 5 VAL HG1% 1.0 0.0 6.5 82 59 A 6 THR HA A 5 VAL HG1% 1.0 0.0 6.5 83 60 A 6 THR HB A 5 VAL HG1% 1.0 0.0 6.5 84 61 A 6 THR HG2% A 5 VAL HG1% 1.0 0.0 6.5 85 62 A 110 SER H A 5 VAL HG2% 1.0 0.0 6.5 86 63 A 110 SER HA A 5 VAL HG2% 1.0 0.0 5.5 87 64 A 110 SER HBy A 5 VAL HG2% 1.0 0.0 6.5 88 65 A 5 VAL HG2% A 110 SER HBx 1.0 0.0 6.5 89 66 A 113 ALA HB% A 5 VAL HG2% 1.0 0.0 6.5 90 67 A 35 LYS HA A 5 VAL HG2% 1.0 0.0 5.5 91 68 A 36 GLN H A 5 VAL HG2% 1.0 0.0 6.5 92 69 A 36 GLN HA A 5 VAL HG2% 1.0 0.0 6.5 93 70 A 36 GLN HBy A 5 VAL HG2% 1.0 0.0 6.5 94 71 A 5 VAL HG2% A 36 GLN HBx 1.0 0.0 6.5 95 72 A 37 ILE HB A 5 VAL HG2% 1.0 0.0 6.5 96 73 A 37 ILE HG2% A 5 VAL HG2% 1.0 0.0 6.5 97 74 A 6 THR H A 5 VAL HG2% 1.0 0.0 6.5 98 75 A 6 THR HA A 5 VAL HG2% 1.0 0.0 6.5 99 76 A 6 THR HB A 5 VAL HG2% 1.0 0.0 6.5 100 77 A 6 THR HG2% A 5 VAL HG2% 1.0 0.0 6.5 101 78 A 5 VAL HG2% A 110 SER HBx 1.0 0.0 5.5 102 78 A 5 VAL HG1% A 110 SER HBx 1.0 0.0 5.5 103 78 A 110 SER HBy A 5 VAL HG2% 1.0 0.0 5.5 104 78 A 110 SER HBy A 5 VAL HG1% 1.0 0.0 5.5 105 79 A 35 LYS H A 5 VAL HG2% 1.0 0.0 6.5 106 79 A 5 VAL HG1% A 35 LYS H 1.0 0.0 6.5 107 80 A 5 VAL HG1% A 36 GLN HBx 1.0 0.0 5.5 108 80 A 5 VAL HG2% A 36 GLN HBx 1.0 0.0 5.5 109 80 A 36 GLN HBy A 5 VAL HG2% 1.0 0.0 5.5 110 80 A 5 VAL HG1% A 36 GLN HBy 1.0 0.0 5.5 111 81 A 6 THR H A 36 GLN HA 1.0 0.0 6.5 112 82 A 6 THR H A 36 GLN HBy 1.0 0.0 6.5 113 83 A 6 THR H A 36 GLN HBx 1.0 0.0 6.5 114 84 A 6 THR H A 36 GLN HBx 1.0 0.0 6.5 115 84 A 6 THR H A 36 GLN HBy 1.0 0.0 6.5 116 85 A 6 THR H A 36 GLN HG3 1.0 0.0 6.5 117 85 A 6 THR H A 36 GLN HG2 1.0 0.0 6.5 118 86 A 6 THR H A 37 ILE H 1.0 0.0 6.5 119 87 A 6 THR H A 6 THR HG2% 1.0 0.0 6.5 120 88 A 6 THR H A 7 VAL H 1.0 0.0 6.5 121 89 A 6 THR HA A 36 GLN HBy 1.0 0.0 6.5 122 90 A 6 THR HA A 36 GLN HBx 1.0 0.0 6.5 123 91 A 6 THR HA A 36 GLN HBx 1.0 0.0 6.5 124 91 A 6 THR HA A 36 GLN HBy 1.0 0.0 6.5 125 92 A 6 THR HA A 7 VAL H 1.0 0.0 5.5 126 93 A 6 THR HB A 36 GLN HBx 1.0 0.0 5.0 127 93 A 6 THR HB A 36 GLN HBy 1.0 0.0 5.0 128 94 A 37 ILE HB A 6 THR HB 1.0 0.0 6.5 129 95 A 6 THR HB A 7 VAL H 1.0 0.0 6.5 130 96 A 37 ILE H A 6 THR O 1.0 0.0 4.5 131 97 A 6 THR O A 37 ILE N 1.0 0.0 4.5 132 98 A 36 GLN HA A 6 THR HG2% 1.0 0.0 6.5 133 99 A 37 ILE HB A 6 THR HG2% 1.0 0.0 6.5 134 100 A 6 THR HG2% A 37 ILE HG12 1.0 0.0 6.5 135 101 A 6 THR HG2% A 37 ILE HG13 1.0 0.0 6.5 136 102 A 37 ILE HG2% A 6 THR HG2% 1.0 0.0 6.5 137 103 A 6 THR HG2% A 7 VAL H 1.0 0.0 6.5 138 104 A 113 ALA HB% A 7 VAL H 1.0 0.0 6.5 139 105 A 7 VAL H A 7 VAL HB 1.0 0.0 5.5 140 106 A 7 VAL H A 7 VAL HGx% 1.0 0.0 6.5 141 107 A 7 VAL H A 7 VAL HGy% 1.0 0.0 6.5 142 108 A 7 VAL H A 7 VAL HGy% 1.0 0.0 6.5 143 108 A 7 VAL H A 7 VAL HGx% 1.0 0.0 6.5 144 109 A 7 VAL H A 8 SER H 1.0 0.0 6.5 145 110 A 37 ILE H A 7 VAL HA 1.0 0.0 6.5 146 111 A 7 VAL HA A 38 ASP H 1.0 0.0 6.5 147 112 A 8 SER H A 7 VAL HA 1.0 0.0 5.5 148 113 A 37 ILE H A 7 VAL HB 1.0 0.0 6.5 149 114 A 7 VAL HB A 8 SER H 1.0 0.0 6.5 150 115 A 7 VAL HGx% A 114 LEU HA 1.0 0.0 6.5 151 116 A 7 VAL HGx% A 114 LEU HB2 1.0 0.0 6.5 152 117 A 7 VAL HGx% A 114 LEU HB3 1.0 0.0 6.5 153 118 A 7 VAL HGx% A 114 LEU HDx% 1.0 0.0 6.5 154 119 A 7 VAL HGx% A 114 LEU HDy% 1.0 0.0 6.5 155 120 A 7 VAL HGx% A 11 CYS HB2 1.0 0.0 6.5 156 121 A 7 VAL HGx% A 11 CYS HB3 1.0 0.0 6.5 157 122 A 37 ILE H A 7 VAL HGx% 1.0 0.0 6.5 158 123 A 7 VAL HGx% A 8 SER H 1.0 0.0 6.5 159 124 A 114 LEU HA A 7 VAL HGy% 1.0 0.0 6.5 160 125 A 114 LEU HB2 A 7 VAL HGy% 1.0 0.0 6.5 161 126 A 7 VAL HGy% A 114 LEU HB3 1.0 0.0 6.5 162 127 A 114 LEU HDx% A 7 VAL HGy% 1.0 0.0 6.5 163 128 A 7 VAL HGy% A 114 LEU HDy% 1.0 0.0 6.5 164 129 A 7 VAL HGy% A 11 CYS HB2 1.0 0.0 6.5 165 130 A 11 CYS HB3 A 7 VAL HGy% 1.0 0.0 6.5 166 131 A 37 ILE H A 7 VAL HGy% 1.0 0.0 6.5 167 132 A 8 SER H A 7 VAL HGy% 1.0 0.0 6.5 168 133 A 113 ALA HB% A 7 VAL HGy% 1.0 0.0 6.5 169 133 A 113 ALA HB% A 7 VAL HGx% 1.0 0.0 6.5 170 134 A 114 LEU H A 7 VAL HGy% 1.0 0.0 6.5 171 134 A 7 VAL HGx% A 114 LEU H 1.0 0.0 6.5 172 135 A 114 LEU HA A 7 VAL HGy% 1.0 0.0 5.5 173 135 A 7 VAL HGx% A 114 LEU HA 1.0 0.0 5.5 174 136 A 7 VAL HGy% A 114 LEU HB3 1.0 0.0 6.5 175 136 A 7 VAL HGx% A 114 LEU HB3 1.0 0.0 6.5 176 136 A 114 LEU HB2 A 7 VAL HGy% 1.0 0.0 6.5 177 136 A 7 VAL HGx% A 114 LEU HB2 1.0 0.0 6.5 178 137 A 7 VAL HGx% A 114 LEU HDy% 1.0 0.0 6.5 179 137 A 7 VAL HGy% A 114 LEU HDy% 1.0 0.0 6.5 180 137 A 114 LEU HDx% A 7 VAL HGy% 1.0 0.0 6.5 181 137 A 7 VAL HGx% A 114 LEU HDx% 1.0 0.0 6.5 182 138 A 117 SER H A 7 VAL HGy% 1.0 0.0 6.5 183 138 A 7 VAL HGx% A 117 SER H 1.0 0.0 6.5 184 139 A 11 CYS H A 7 VAL HGy% 1.0 0.0 6.5 185 139 A 7 VAL HGx% A 11 CYS H 1.0 0.0 6.5 186 140 A 11 CYS HA A 7 VAL HGy% 1.0 0.0 6.5 187 140 A 7 VAL HGx% A 11 CYS HA 1.0 0.0 6.5 188 141 A 7 VAL HGx% A 11 CYS HB2 1.0 0.0 6.5 189 141 A 7 VAL HGy% A 11 CYS HB2 1.0 0.0 6.5 190 141 A 11 CYS HB3 A 7 VAL HGy% 1.0 0.0 6.5 191 141 A 7 VAL HGx% A 11 CYS HB3 1.0 0.0 6.5 192 142 A 12 LYS H A 7 VAL HGy% 1.0 0.0 6.5 193 142 A 7 VAL HGx% A 12 LYS H 1.0 0.0 6.5 194 143 A 37 ILE H A 7 VAL HGy% 1.0 0.0 6.5 195 143 A 37 ILE H A 7 VAL HGx% 1.0 0.0 6.5 196 144 A 38 ASP H A 7 VAL HGy% 1.0 0.0 6.5 197 144 A 7 VAL HGx% A 38 ASP H 1.0 0.0 6.5 198 145 A 38 ASP HA A 7 VAL HGy% 1.0 0.0 6.5 199 145 A 7 VAL HGx% A 38 ASP HA 1.0 0.0 6.5 200 146 A 7 VAL HGy% A 38 ASP HBy 1.0 0.0 6.5 201 146 A 7 VAL HGx% A 38 ASP HBy 1.0 0.0 6.5 202 146 A 38 ASP HBx A 7 VAL HGy% 1.0 0.0 6.5 203 146 A 7 VAL HGx% A 38 ASP HBx 1.0 0.0 6.5 204 147 A 39 VAL H A 7 VAL HGy% 1.0 0.0 6.5 205 147 A 7 VAL HGx% A 39 VAL H 1.0 0.0 6.5 206 148 A 8 SER H A 7 VAL HGy% 1.0 0.0 6.5 207 148 A 7 VAL HGx% A 8 SER H 1.0 0.0 6.5 208 149 A 8 SER H A 11 CYS H 1.0 0.0 6.5 209 150 A 8 SER H A 11 CYS HB2 1.0 0.0 6.5 210 151 A 8 SER H A 11 CYS HB3 1.0 0.0 6.5 211 152 A 37 ILE H A 8 SER H 1.0 0.0 6.5 212 153 A 37 ILE HB A 8 SER H 1.0 0.0 6.5 213 154 A 37 ILE HG12 A 8 SER H 1.0 0.0 6.5 214 155 A 37 ILE HG13 A 8 SER H 1.0 0.0 6.5 215 156 A 8 SER H A 37 ILE O 1.0 0.0 4.5 216 157 A 8 SER H A 38 ASP HA 1.0 0.0 6.5 217 158 A 8 SER H A 38 ASP HBy 1.0 0.0 6.5 218 159 A 8 SER H A 38 ASP HBx 1.0 0.0 6.5 219 160 A 8 SER H A 38 ASP HBy 1.0 0.0 6.5 220 160 A 8 SER H A 38 ASP HBx 1.0 0.0 6.5 221 161 A 8 SER H A 8 SER HBy 1.0 0.0 6.5 222 162 A 8 SER H A 8 SER HBx 1.0 0.0 6.5 223 163 A 8 SER H A 8 SER HBx 1.0 0.0 5.5 224 163 A 8 SER H A 8 SER HBy 1.0 0.0 5.5 225 164 A 8 SER H A 9 ASP H 1.0 0.0 6.5 226 165 A 38 ASP HA A 8 SER HA 1.0 0.0 6.5 227 166 A 8 SER HA A 38 ASP HBy 1.0 0.0 6.5 228 166 A 38 ASP HBx A 8 SER HA 1.0 0.0 6.5 229 167 A 8 SER HBy A 10 VAL HA 1.0 0.0 6.5 230 168 A 8 SER HBy A 10 VAL HB 1.0 0.0 6.5 231 169 A 8 SER HBy A 10 VAL HGx% 1.0 0.0 6.5 232 170 A 8 SER HBy A 10 VAL HGy% 1.0 0.0 6.5 233 171 A 37 ILE HG2% A 8 SER HBy 1.0 0.0 6.5 234 172 A 38 ASP HA A 8 SER HBy 1.0 0.0 5.5 235 173 A 8 SER HBy A 9 ASP H 1.0 0.0 6.5 236 174 A 10 VAL HA A 8 SER HBx 1.0 0.0 6.5 237 175 A 10 VAL HB A 8 SER HBx 1.0 0.0 5.5 238 176 A 10 VAL HGx% A 8 SER HBx 1.0 0.0 6.5 239 177 A 8 SER HBx A 10 VAL HGy% 1.0 0.0 6.5 240 178 A 37 ILE HG2% A 8 SER HBx 1.0 0.0 6.5 241 179 A 38 ASP HA A 8 SER HBx 1.0 0.0 5.5 242 180 A 9 ASP H A 8 SER HBx 1.0 0.0 6.5 243 181 A 37 ILE O A 8 SER N 1.0 0.0 4.5 244 182 A 10 VAL H A 8 SER HBx 1.0 0.0 6.5 245 182 A 8 SER HBy A 10 VAL H 1.0 0.0 6.5 246 183 A 10 VAL HA A 8 SER HBx 1.0 0.0 6.5 247 183 A 8 SER HBy A 10 VAL HA 1.0 0.0 6.5 248 184 A 10 VAL HB A 8 SER HBx 1.0 0.0 5.5 249 184 A 8 SER HBy A 10 VAL HB 1.0 0.0 5.5 250 185 A 8 SER HBy A 10 VAL HGy% 1.0 0.0 5.5 251 185 A 8 SER HBx A 10 VAL HGy% 1.0 0.0 5.5 252 185 A 10 VAL HGx% A 8 SER HBx 1.0 0.0 5.5 253 185 A 8 SER HBy A 10 VAL HGx% 1.0 0.0 5.5 254 186 A 11 CYS H A 8 SER HBx 1.0 0.0 5.5 255 186 A 11 CYS H A 8 SER HBy 1.0 0.0 5.5 256 187 A 37 ILE HG2% A 8 SER HBx 1.0 0.0 6.5 257 187 A 37 ILE HG2% A 8 SER HBy 1.0 0.0 6.5 258 188 A 8 SER HBx A 38 ASP HBy 1.0 0.0 6.5 259 188 A 8 SER HBy A 38 ASP HBy 1.0 0.0 6.5 260 188 A 38 ASP HBx A 8 SER HBx 1.0 0.0 6.5 261 188 A 38 ASP HBx A 8 SER HBy 1.0 0.0 6.5 262 189 A 9 ASP H A 8 SER HBx 1.0 0.0 6.5 263 189 A 8 SER HBy A 9 ASP H 1.0 0.0 6.5 264 190 A 9 ASP H A 10 VAL H 1.0 0.0 6.5 265 191 A 11 CYS H A 9 ASP H 1.0 0.0 6.5 266 192 A 10 VAL HA A 9 ASP HA 1.0 0.0 6.5 267 193 A 11 CYS H A 9 ASP HA 1.0 0.0 6.5 268 194 A 12 LYS H A 9 ASP HA 1.0 0.0 6.5 269 195 A 9 ASP HA A 13 THR H 1.0 0.0 6.5 270 196 A 10 VAL H A 9 ASP HBy 1.0 0.0 6.5 271 197 A 10 VAL HA A 9 ASP HBy 1.0 0.0 6.5 272 198 A 10 VAL H A 9 ASP HBx 1.0 0.0 6.5 273 199 A 10 VAL HA A 9 ASP HBx 1.0 0.0 6.5 274 200 A 10 VAL H A 9 ASP HBy 1.0 0.0 5.5 275 200 A 10 VAL H A 9 ASP HBx 1.0 0.0 5.5 276 201 A 10 VAL HA A 9 ASP HBy 1.0 0.0 6.5 277 201 A 10 VAL HA A 9 ASP HBx 1.0 0.0 6.5 278 202 A 10 VAL HB A 9 ASP HBy 1.0 0.0 6.5 279 202 A 10 VAL HB A 9 ASP HBx 1.0 0.0 6.5 280 203 A 9 ASP HBy A 10 VAL HGy% 1.0 0.0 5.5 281 203 A 9 ASP HBx A 10 VAL HGy% 1.0 0.0 5.5 282 203 A 10 VAL HGx% A 9 ASP HBy 1.0 0.0 5.5 283 203 A 10 VAL HGx% A 9 ASP HBx 1.0 0.0 5.5 284 204 A 13 THR HA A 9 ASP HBy 1.0 0.0 6.5 285 204 A 9 ASP HBx A 13 THR HA 1.0 0.0 6.5 286 205 A 13 THR HB A 9 ASP HBy 1.0 0.0 6.5 287 205 A 9 ASP HBx A 13 THR HB 1.0 0.0 6.5 288 206 A 13 THR HG2% A 9 ASP HBy 1.0 0.0 6.5 289 206 A 9 ASP HBx A 13 THR HG2% 1.0 0.0 6.5 290 207 A 10 VAL HB A 10 VAL H 1.0 0.0 5.5 291 208 A 10 VAL H A 10 VAL HGx% 1.0 0.0 6.5 292 209 A 10 VAL H A 10 VAL HGy% 1.0 0.0 6.5 293 210 A 10 VAL H A 10 VAL HGy% 1.0 0.0 5.5 294 210 A 10 VAL H A 10 VAL HGx% 1.0 0.0 5.5 295 211 A 11 CYS H A 10 VAL H 1.0 0.0 5.5 296 212 A 10 VAL H A 11 CYS HB2 1.0 0.0 6.5 297 213 A 11 CYS HB3 A 10 VAL H 1.0 0.0 6.5 298 214 A 12 LYS H A 10 VAL H 1.0 0.0 6.5 299 215 A 11 CYS H A 10 VAL HA 1.0 0.0 6.5 300 216 A 12 LYS H A 10 VAL HA 1.0 0.0 6.5 301 217 A 10 VAL HA A 13 THR H 1.0 0.0 6.5 302 218 A 10 VAL HA A 13 THR HB 1.0 0.0 6.5 303 219 A 10 VAL HA A 13 THR HG2% 1.0 0.0 5.5 304 220 A 10 VAL HA A 14 THR H 1.0 0.0 6.5 305 221 A 11 CYS H A 10 VAL HB 1.0 0.0 6.5 306 222 A 10 VAL HB A 40 GLU HG2 1.0 0.0 6.5 307 223 A 10 VAL HB A 40 GLU HG3 1.0 0.0 6.5 308 224 A 11 CYS H A 10 VAL HGx% 1.0 0.0 6.5 309 225 A 10 VAL HGx% A 40 GLU H 1.0 0.0 6.5 310 226 A 10 VAL HGx% A 40 GLU HG2 1.0 0.0 6.5 311 227 A 10 VAL HGx% A 40 GLU HG3 1.0 0.0 6.5 312 228 A 11 CYS H A 10 VAL HGy% 1.0 0.0 6.5 313 229 A 40 GLU H A 10 VAL HGy% 1.0 0.0 6.5 314 230 A 40 GLU HG2 A 10 VAL HGy% 1.0 0.0 6.5 315 231 A 40 GLU HG3 A 10 VAL HGy% 1.0 0.0 6.5 316 232 A 11 CYS H A 10 VAL HGy% 1.0 0.0 6.5 317 232 A 11 CYS H A 10 VAL HGx% 1.0 0.0 6.5 318 233 A 11 CYS HA A 10 VAL HGy% 1.0 0.0 6.5 319 233 A 11 CYS HA A 10 VAL HGx% 1.0 0.0 6.5 320 234 A 10 VAL HGx% A 11 CYS HB2 1.0 0.0 6.5 321 234 A 11 CYS HB3 A 10 VAL HGy% 1.0 0.0 6.5 322 234 A 11 CYS HB3 A 10 VAL HGx% 1.0 0.0 6.5 323 234 A 10 VAL HGy% A 11 CYS HB2 1.0 0.0 6.5 324 235 A 13 THR HA A 10 VAL HGy% 1.0 0.0 6.5 325 235 A 10 VAL HGx% A 13 THR HA 1.0 0.0 6.5 326 236 A 13 THR HB A 10 VAL HGy% 1.0 0.0 6.5 327 236 A 10 VAL HGx% A 13 THR HB 1.0 0.0 6.5 328 237 A 13 THR HG2% A 10 VAL HGy% 1.0 0.0 6.5 329 237 A 10 VAL HGx% A 13 THR HG2% 1.0 0.0 6.5 330 238 A 38 ASP HA A 10 VAL HGy% 1.0 0.0 6.5 331 238 A 38 ASP HA A 10 VAL HGx% 1.0 0.0 6.5 332 239 A 10 VAL HGx% A 38 ASP HBy 1.0 0.0 6.5 333 239 A 10 VAL HGy% A 38 ASP HBy 1.0 0.0 6.5 334 239 A 38 ASP HBx A 10 VAL HGy% 1.0 0.0 6.5 335 239 A 38 ASP HBx A 10 VAL HGx% 1.0 0.0 6.5 336 240 A 40 GLU H A 10 VAL HGy% 1.0 0.0 6.5 337 240 A 10 VAL HGx% A 40 GLU H 1.0 0.0 6.5 338 241 A 10 VAL HGx% A 42 VAL HGy% 1.0 0.0 6.5 339 241 A 10 VAL HGy% A 42 VAL HGy% 1.0 0.0 6.5 340 241 A 42 VAL HGx% A 10 VAL HGy% 1.0 0.0 6.5 341 241 A 10 VAL HGx% A 42 VAL HGx% 1.0 0.0 6.5 342 242 A 11 CYS H A 11 CYS HB2 1.0 0.0 5.5 343 243 A 11 CYS H A 11 CYS HB3 1.0 0.0 5.5 344 244 A 11 CYS H A 12 LYS H 1.0 0.0 5.5 345 245 A 11 CYS H A 12 LYS HB2 1.0 0.0 6.5 346 246 A 11 CYS H A 12 LYS HB3 1.0 0.0 6.5 347 247 A 11 CYS H A 13 THR H 1.0 0.0 6.5 348 248 A 11 CYS H A 39 VAL HB 1.0 0.0 6.5 349 249 A 11 CYS H A 39 VAL HGx% 1.0 0.0 6.5 350 250 A 11 CYS H A 39 VAL HGy% 1.0 0.0 6.5 351 251 A 11 CYS H A 39 VAL HGy% 1.0 0.0 6.5 352 251 A 11 CYS H A 39 VAL HGx% 1.0 0.0 6.5 353 252 A 11 CYS HA A 12 LYS H 1.0 0.0 6.5 354 253 A 11 CYS HA A 13 THR H 1.0 0.0 6.5 355 254 A 11 CYS HA A 14 THR H 1.0 0.0 6.5 356 255 A 11 CYS HA A 14 THR HB 1.0 0.0 6.5 357 256 A 11 CYS HA A 15 TYR H 1.0 0.0 6.5 358 257 A 12 LYS H A 11 CYS HB2 1.0 0.0 6.5 359 258 A 13 THR H A 11 CYS HB2 1.0 0.0 6.5 360 259 A 38 ASP HA A 11 CYS HB2 1.0 0.0 6.5 361 260 A 39 VAL H A 11 CYS HB2 1.0 0.0 6.5 362 261 A 11 CYS HB3 A 12 LYS H 1.0 0.0 6.5 363 262 A 11 CYS HB3 A 13 THR H 1.0 0.0 6.5 364 263 A 11 CYS HB3 A 38 ASP HA 1.0 0.0 6.5 365 264 A 11 CYS HB3 A 39 VAL H 1.0 0.0 6.5 366 265 A 11 CYS HB2 A 114 LEU HDy% 1.0 0.0 6.5 367 265 A 11 CYS HB3 A 114 LEU HDy% 1.0 0.0 6.5 368 265 A 114 LEU HDx% A 11 CYS HB2 1.0 0.0 6.5 369 265 A 114 LEU HDx% A 11 CYS HB3 1.0 0.0 6.5 370 266 A 11 CYS HB2 A 118 LEU HB3 1.0 0.0 6.5 371 266 A 11 CYS HB3 A 118 LEU HB3 1.0 0.0 6.5 372 266 A 118 LEU HB2 A 11 CYS HB2 1.0 0.0 6.5 373 266 A 11 CYS HB3 A 118 LEU HB2 1.0 0.0 6.5 374 267 A 12 LYS H A 12 LYS HB2 1.0 0.0 6.5 375 268 A 12 LYS H A 12 LYS HB3 1.0 0.0 6.5 376 269 A 12 LYS H A 12 LYS HD2 1.0 0.0 6.5 377 270 A 12 LYS H A 12 LYS HD3 1.0 0.0 6.5 378 271 A 12 LYS H A 12 LYS HE2 1.0 0.0 6.5 379 272 A 12 LYS H A 12 LYS HE3 1.0 0.0 6.5 380 273 A 12 LYS H A 12 LYS HGx 1.0 0.0 6.5 381 273 A 12 LYS H A 12 LYS HGy 1.0 0.0 6.5 382 274 A 12 LYS H A 13 THR H 1.0 0.0 5.5 383 275 A 12 LYS H A 14 THR H 1.0 0.0 6.5 384 276 A 12 LYS H A 39 VAL HGy% 1.0 0.0 6.5 385 276 A 12 LYS H A 39 VAL HGx% 1.0 0.0 6.5 386 277 A 13 THR H A 12 LYS HA 1.0 0.0 5.5 387 278 A 14 THR H A 12 LYS HA 1.0 0.0 6.5 388 279 A 15 TYR H A 12 LYS HA 1.0 0.0 6.5 389 280 A 12 LYS HA A 15 TYR HA 1.0 0.0 6.5 390 281 A 12 LYS HA A 15 TYR HBy 1.0 0.0 6.5 391 282 A 12 LYS HA A 15 TYR HBx 1.0 0.0 6.5 392 283 A 12 LYS HA A 16 GLU H 1.0 0.0 6.5 393 284 A 13 THR H A 12 LYS HB2 1.0 0.0 6.5 394 285 A 14 THR H A 12 LYS HB2 1.0 0.0 6.5 395 286 A 12 LYS HB2 A 15 TYR H 1.0 0.0 6.5 396 287 A 13 THR H A 12 LYS HB3 1.0 0.0 6.5 397 288 A 14 THR H A 12 LYS HB3 1.0 0.0 6.5 398 289 A 12 LYS HB3 A 15 TYR H 1.0 0.0 6.5 399 290 A 13 THR H A 12 LYS HD2 1.0 0.0 6.5 400 291 A 13 THR H A 12 LYS HD3 1.0 0.0 6.5 401 292 A 13 THR H A 12 LYS HE2 1.0 0.0 6.5 402 293 A 13 THR H A 12 LYS HE3 1.0 0.0 6.5 403 294 A 12 LYS HGy A 16 GLU H 1.0 0.0 6.5 404 295 A 16 GLU H A 12 LYS HGx 1.0 0.0 6.5 405 296 A 13 THR H A 12 LYS HGx 1.0 0.0 6.5 406 296 A 13 THR H A 12 LYS HGy 1.0 0.0 6.5 407 297 A 16 GLU H A 12 LYS HGx 1.0 0.0 6.5 408 297 A 12 LYS HGy A 16 GLU H 1.0 0.0 6.5 409 298 A 13 THR H A 13 THR HB 1.0 0.0 5.5 410 299 A 13 THR H A 13 THR HG2% 1.0 0.0 6.5 411 300 A 13 THR H A 14 THR H 1.0 0.0 5.5 412 301 A 13 THR H A 14 THR HG2% 1.0 0.0 6.5 413 302 A 13 THR H A 15 TYR H 1.0 0.0 6.5 414 303 A 13 THR HA A 14 THR H 1.0 0.0 6.5 415 304 A 13 THR HA A 16 GLU HA 1.0 0.0 6.5 416 305 A 13 THR HA A 16 GLU HBy 1.0 0.0 6.5 417 306 A 13 THR HA A 16 GLU HBx 1.0 0.0 5.5 418 307 A 13 THR HA A 16 GLU HG2 1.0 0.0 6.5 419 308 A 13 THR HA A 16 GLU HG3 1.0 0.0 6.5 420 309 A 13 THR HB A 14 THR H 1.0 0.0 6.5 421 310 A 13 THR HB A 15 TYR H 1.0 0.0 6.5 422 311 A 13 THR HB A 16 GLU H 1.0 0.0 6.5 423 312 A 13 THR HB A 17 GLU H 1.0 0.0 6.5 424 313 A 13 THR HG2% A 14 THR H 1.0 0.0 6.5 425 314 A 13 THR HG2% A 16 GLU HBy 1.0 0.0 6.5 426 315 A 13 THR HG2% A 16 GLU HBx 1.0 0.0 6.5 427 316 A 13 THR HG2% A 16 GLU HG2 1.0 0.0 6.5 428 317 A 13 THR HG2% A 16 GLU HG3 1.0 0.0 6.5 429 318 A 13 THR HG2% A 16 GLU HBx 1.0 0.0 6.5 430 318 A 13 THR HG2% A 16 GLU HBy 1.0 0.0 6.5 431 319 A 14 THR H A 14 THR HB 1.0 0.0 6.5 432 320 A 14 THR H A 14 THR HG2% 1.0 0.0 6.5 433 321 A 14 THR H A 15 TYR H 1.0 0.0 6.5 434 322 A 14 THR H A 16 GLU H 1.0 0.0 6.5 435 323 A 14 THR H A 39 VAL HGy% 1.0 0.0 6.5 436 323 A 14 THR H A 39 VAL HGx% 1.0 0.0 6.5 437 324 A 14 THR HA A 17 GLU HB2 1.0 0.0 6.5 438 325 A 14 THR HA A 17 GLU HB3 1.0 0.0 6.5 439 326 A 14 THR HA A 27 VAL HGx% 1.0 0.0 6.5 440 327 A 14 THR HA A 27 VAL HGy% 1.0 0.0 6.5 441 328 A 14 THR HA A 27 VAL HGy% 1.0 0.0 6.5 442 328 A 14 THR HA A 27 VAL HGx% 1.0 0.0 6.5 443 329 A 42 VAL HGx% A 14 THR HA 1.0 0.0 6.5 444 330 A 14 THR HA A 42 VAL HGy% 1.0 0.0 6.5 445 331 A 14 THR HA A 42 VAL HGy% 1.0 0.0 6.5 446 331 A 42 VAL HGx% A 14 THR HA 1.0 0.0 6.5 447 332 A 14 THR HB A 15 TYR H 1.0 0.0 5.5 448 333 A 15 TYR H A 14 THR HG2% 1.0 0.0 6.5 449 334 A 14 THR HG2% A 17 GLU HB2 1.0 0.0 6.5 450 335 A 14 THR HG2% A 17 GLU HB3 1.0 0.0 6.5 451 336 A 14 THR HG2% A 18 ILE HA 1.0 0.0 6.5 452 337 A 14 THR HG2% A 18 ILE HB 1.0 0.0 6.5 453 338 A 14 THR HG2% A 18 ILE HD1% 1.0 0.0 6.5 454 339 A 14 THR HG2% A 27 VAL HA 1.0 0.0 6.5 455 340 A 14 THR HG2% A 27 VAL HB 1.0 0.0 6.5 456 341 A 14 THR HG2% A 27 VAL HGx% 1.0 0.0 6.5 457 342 A 14 THR HG2% A 27 VAL HGy% 1.0 0.0 6.5 458 343 A 14 THR HG2% A 42 VAL HA 1.0 0.0 6.5 459 344 A 15 TYR H A 15 TYR HBy 1.0 0.0 6.5 460 345 A 15 TYR H A 15 TYR HBx 1.0 0.0 6.5 461 346 A 15 TYR H A 16 GLU H 1.0 0.0 6.5 462 347 A 15 TYR H A 17 GLU H 1.0 0.0 6.5 463 348 A 15 TYR H A 27 VAL HB 1.0 0.0 6.5 464 349 A 15 TYR H A 27 VAL HGy% 1.0 0.0 6.5 465 349 A 15 TYR H A 27 VAL HGx% 1.0 0.0 6.5 466 350 A 15 TYR HA A 118 LEU HDy% 1.0 0.0 6.5 467 350 A 15 TYR HA A 118 LEU HDx% 1.0 0.0 6.5 468 351 A 15 TYR HA A 17 GLU H 1.0 0.0 6.5 469 352 A 15 TYR HA A 18 ILE H 1.0 0.0 6.5 470 353 A 15 TYR HA A 18 ILE HA 1.0 0.0 6.5 471 354 A 15 TYR HA A 18 ILE HB 1.0 0.0 6.5 472 355 A 15 TYR HA A 18 ILE HD1% 1.0 0.0 6.5 473 356 A 15 TYR HA A 19 LYS H 1.0 0.0 6.5 474 357 A 16 GLU H A 15 TYR HBy 1.0 0.0 6.5 475 358 A 16 GLU H A 15 TYR HBx 1.0 0.0 6.5 476 359 A 15 TYR HD2 A 121 VAL H 1.0 0.0 6.5 477 360 A 15 TYR HE2 A 118 LEU H 1.0 0.0 6.5 478 361 A 15 TYR HE2 A 119 VAL H 1.0 0.0 6.5 479 362 A 121 VAL H A 15 TYR HE2 1.0 0.0 6.5 480 363 A 15 TYR HBx A 118 LEU HDy% 1.0 0.0 6.5 481 363 A 118 LEU HDx% A 15 TYR HBy 1.0 0.0 6.5 482 363 A 118 LEU HDx% A 15 TYR HBx 1.0 0.0 6.5 483 363 A 15 TYR HBy A 118 LEU HDy% 1.0 0.0 6.5 484 364 A 16 GLU H A 16 GLU HBy 1.0 0.0 6.5 485 365 A 16 GLU H A 16 GLU HBx 1.0 0.0 6.5 486 366 A 16 GLU H A 16 GLU HG2 1.0 0.0 6.5 487 367 A 16 GLU H A 16 GLU HG3 1.0 0.0 6.5 488 368 A 16 GLU H A 16 GLU HBx 1.0 0.0 5.5 489 368 A 16 GLU H A 16 GLU HBy 1.0 0.0 5.5 490 369 A 16 GLU H A 17 GLU H 1.0 0.0 6.5 491 370 A 16 GLU H A 18 ILE H 1.0 0.0 6.5 492 371 A 16 GLU HA A 119 VAL HGy% 1.0 0.0 6.5 493 371 A 16 GLU HA A 119 VAL HGx% 1.0 0.0 6.5 494 372 A 16 GLU HA A 18 ILE H 1.0 0.0 6.5 495 373 A 16 GLU HA A 19 LYS H 1.0 0.0 6.5 496 374 A 16 GLU HA A 19 LYS HD2 1.0 0.0 6.5 497 375 A 16 GLU HA A 19 LYS HD3 1.0 0.0 6.5 498 376 A 16 GLU HA A 20 LYS H 1.0 0.0 6.5 499 377 A 16 GLU HG2 A 17 GLU H 1.0 0.0 6.5 500 378 A 16 GLU HG3 A 17 GLU H 1.0 0.0 6.5 501 379 A 17 GLU H A 16 GLU HBx 1.0 0.0 6.5 502 379 A 17 GLU H A 16 GLU HBy 1.0 0.0 6.5 503 380 A 17 GLU H A 17 GLU HA 1.0 0.0 5.5 504 381 A 17 GLU H A 17 GLU HB2 1.0 0.0 6.5 505 382 A 17 GLU H A 17 GLU HB3 1.0 0.0 6.5 506 383 A 17 GLU H A 17 GLU HG2 1.0 0.0 6.5 507 384 A 17 GLU H A 17 GLU HG3 1.0 0.0 6.5 508 385 A 17 GLU H A 18 ILE H 1.0 0.0 6.5 509 386 A 17 GLU H A 19 LYS H 1.0 0.0 6.5 510 387 A 19 LYS H A 17 GLU HA 1.0 0.0 6.5 511 388 A 20 LYS H A 17 GLU HA 1.0 0.0 6.5 512 389 A 17 GLU HA A 20 LYS HB2 1.0 0.0 6.5 513 390 A 17 GLU HA A 20 LYS HB3 1.0 0.0 6.5 514 391 A 17 GLU HA A 21 ASP H 1.0 0.0 6.5 515 392 A 17 GLU HA A 21 ASP HB2 1.0 0.0 5.5 516 393 A 17 GLU HA A 21 ASP HB3 1.0 0.0 6.5 517 394 A 17 GLU HB2 A 18 ILE H 1.0 0.0 6.5 518 395 A 17 GLU HB3 A 18 ILE H 1.0 0.0 6.5 519 396 A 17 GLU HB3 A 21 ASP HA 1.0 0.0 6.5 520 397 A 18 ILE H A 17 GLU HG2 1.0 0.0 6.5 521 398 A 18 ILE H A 17 GLU HG3 1.0 0.0 6.5 522 399 A 24 HIS H A 17 GLU HG3 1.0 0.0 6.5 523 399 A 17 GLU HG2 A 24 HIS H 1.0 0.0 6.5 524 400 A 18 ILE HB A 18 ILE H 1.0 0.0 5.5 525 401 A 18 ILE HD1% A 18 ILE H 1.0 0.0 6.5 526 402 A 18 ILE H A 18 ILE HG1x 1.0 0.0 6.5 527 402 A 18 ILE H A 18 ILE HG1y 1.0 0.0 6.5 528 403 A 18 ILE H A 18 ILE HG2% 1.0 0.0 6.5 529 404 A 18 ILE H A 19 LYS H 1.0 0.0 5.5 530 405 A 18 ILE H A 20 LYS H 1.0 0.0 6.5 531 406 A 18 ILE H A 23 LYS H 1.0 0.0 6.5 532 407 A 18 ILE H A 24 HIS H 1.0 0.0 6.5 533 408 A 18 ILE H A 24 HIS HB2 1.0 0.0 6.5 534 408 A 18 ILE H A 24 HIS HB3 1.0 0.0 6.5 535 409 A 18 ILE HA A 19 LYS H 1.0 0.0 6.5 536 410 A 18 ILE HA A 20 LYS H 1.0 0.0 6.5 537 411 A 18 ILE HA A 21 ASP H 1.0 0.0 6.5 538 412 A 18 ILE HA A 22 LYS H 1.0 0.0 6.5 539 413 A 18 ILE HA A 22 LYS HG2 1.0 0.0 6.5 540 414 A 18 ILE HA A 22 LYS HG3 1.0 0.0 6.5 541 415 A 18 ILE HA A 24 HIS HA 1.0 0.0 6.5 542 416 A 18 ILE HB A 19 LYS H 1.0 0.0 6.5 543 417 A 18 ILE HB A 24 HIS H 1.0 0.0 6.5 544 418 A 19 LYS H A 18 ILE HG1y 1.0 0.0 6.5 545 419 A 18 ILE HG1y A 22 LYS HG2 1.0 0.0 6.5 546 420 A 18 ILE HG1y A 22 LYS HG3 1.0 0.0 6.5 547 421 A 24 HIS H A 18 ILE HG1y 1.0 0.0 6.5 548 422 A 18 ILE HG1y A 24 HIS HB2 1.0 0.0 6.5 549 423 A 18 ILE HG1y A 24 HIS HB3 1.0 0.0 6.5 550 424 A 19 LYS H A 18 ILE HG1x 1.0 0.0 6.5 551 425 A 18 ILE HG1x A 22 LYS HG3 1.0 0.0 6.5 552 426 A 24 HIS H A 18 ILE HG1x 1.0 0.0 6.5 553 427 A 18 ILE HG1x A 24 HIS HB2 1.0 0.0 5.5 554 428 A 24 HIS HB3 A 18 ILE HG1x 1.0 0.0 5.0 555 429 A 18 ILE HD1% A 19 LYS H 1.0 0.0 6.5 556 430 A 18 ILE HD1% A 24 HIS H 1.0 0.0 6.5 557 431 A 18 ILE HD1% A 25 ARG H 1.0 0.0 6.5 558 432 A 18 ILE HD1% A 26 TYR H 1.0 0.0 6.5 559 433 A 18 ILE HD1% A 27 VAL HGy% 1.0 0.0 6.5 560 433 A 27 VAL HGx% A 18 ILE HD1% 1.0 0.0 6.5 561 434 A 18 ILE HD1% A 70 ASP H 1.0 0.0 6.5 562 435 A 18 ILE HD1% A 70 ASP HA 1.0 0.0 6.5 563 436 A 18 ILE HD1% A 70 ASP HB2 1.0 0.0 6.5 564 437 A 18 ILE HD1% A 70 ASP HB3 1.0 0.0 6.5 565 438 A 18 ILE HD1% A 89 LEU HA 1.0 0.0 6.5 566 439 A 18 ILE HD1% A 89 LEU HD1% 1.0 0.0 6.5 567 440 A 18 ILE HD1% A 89 LEU HD2% 1.0 0.0 6.5 568 441 A 19 LYS H A 18 ILE HG1x 1.0 0.0 6.5 569 441 A 19 LYS H A 18 ILE HG1y 1.0 0.0 6.5 570 442 A 18 ILE HG1x A 22 LYS HG3 1.0 0.0 6.5 571 442 A 18 ILE HG1y A 22 LYS HG3 1.0 0.0 6.5 572 442 A 22 LYS HG2 A 18 ILE HG1x 1.0 0.0 6.5 573 442 A 18 ILE HG1y A 22 LYS HG2 1.0 0.0 6.5 574 443 A 24 HIS H A 18 ILE HG1x 1.0 0.0 5.5 575 443 A 24 HIS H A 18 ILE HG1y 1.0 0.0 5.5 576 444 A 18 ILE HG1y A 24 HIS HB2 1.0 0.0 5.0 577 444 A 18 ILE HG1x A 24 HIS HB2 1.0 0.0 5.0 578 444 A 24 HIS HB3 A 18 ILE HG1x 1.0 0.0 5.0 579 444 A 18 ILE HG1y A 24 HIS HB3 1.0 0.0 5.0 580 445 A 70 ASP H A 18 ILE HG1x 1.0 0.0 6.5 581 445 A 18 ILE HG1y A 70 ASP H 1.0 0.0 6.5 582 446 A 70 ASP HA A 18 ILE HG1x 1.0 0.0 6.5 583 446 A 18 ILE HG1y A 70 ASP HA 1.0 0.0 6.5 584 447 A 18 ILE HG1y A 70 ASP HB2 1.0 0.0 5.5 585 447 A 70 ASP HB3 A 18 ILE HG1x 1.0 0.0 5.5 586 447 A 18 ILE HG1y A 70 ASP HB3 1.0 0.0 5.5 587 447 A 18 ILE HG1x A 70 ASP HB2 1.0 0.0 5.5 588 448 A 19 LYS H A 18 ILE HG2% 1.0 0.0 6.5 589 449 A 24 HIS H A 18 ILE HG2% 1.0 0.0 6.5 590 450 A 18 ILE HG2% A 24 HIS HA 1.0 0.0 6.5 591 451 A 18 ILE HG2% A 70 ASP H 1.0 0.0 6.5 592 452 A 19 LYS H A 19 LYS HD2 1.0 0.0 6.5 593 453 A 19 LYS H A 19 LYS HD3 1.0 0.0 6.5 594 454 A 19 LYS H A 19 LYS HE2 1.0 0.0 6.5 595 455 A 19 LYS H A 19 LYS HE3 1.0 0.0 6.5 596 456 A 19 LYS H A 19 LYS HG2 1.0 0.0 6.5 597 457 A 19 LYS H A 19 LYS HG3 1.0 0.0 5.5 598 458 A 19 LYS H A 20 LYS H 1.0 0.0 6.5 599 459 A 19 LYS H A 21 ASP H 1.0 0.0 6.5 600 460 A 19 LYS HA A 20 LYS HG3 1.0 0.0 6.5 601 460 A 19 LYS HA A 20 LYS HG2 1.0 0.0 6.5 602 461 A 20 LYS H A 19 LYS HB2 1.0 0.0 6.5 603 462 A 20 LYS H A 19 LYS HB3 1.0 0.0 6.5 604 463 A 19 LYS HD2 A 20 LYS H 1.0 0.0 6.5 605 464 A 19 LYS HD3 A 20 LYS H 1.0 0.0 6.5 606 465 A 20 LYS H A 19 LYS HG2 1.0 0.0 6.5 607 466 A 20 LYS H A 19 LYS HG3 1.0 0.0 6.5 608 467 A 19 LYS HG2 A 119 VAL HGy% 1.0 0.0 6.5 609 467 A 19 LYS HG3 A 119 VAL HGy% 1.0 0.0 6.5 610 467 A 119 VAL HGx% A 19 LYS HG3 1.0 0.0 6.5 611 467 A 119 VAL HGx% A 19 LYS HG2 1.0 0.0 6.5 612 468 A 20 LYS H A 20 LYS HB2 1.0 0.0 5.5 613 469 A 20 LYS H A 20 LYS HB3 1.0 0.0 6.5 614 470 A 20 LYS H A 20 LYS HD2 1.0 0.0 6.5 615 471 A 20 LYS H A 20 LYS HD3 1.0 0.0 6.5 616 472 A 20 LYS H A 20 LYS HG2 1.0 0.0 6.5 617 473 A 20 LYS H A 20 LYS HG3 1.0 0.0 6.5 618 474 A 20 LYS H A 20 LYS HE2 1.0 0.0 6.5 619 474 A 20 LYS H A 20 LYS HE3 1.0 0.0 6.5 620 475 A 20 LYS H A 21 ASP H 1.0 0.0 5.5 621 476 A 20 LYS H A 21 ASP HA 1.0 0.0 6.5 622 477 A 20 LYS H A 21 ASP HB2 1.0 0.0 6.5 623 478 A 20 LYS H A 21 ASP HB3 1.0 0.0 6.5 624 479 A 20 LYS H A 22 LYS H 1.0 0.0 6.5 625 480 A 22 LYS H A 20 LYS HA 1.0 0.0 6.5 626 481 A 20 LYS HB2 A 21 ASP H 1.0 0.0 6.5 627 482 A 20 LYS HB3 A 21 ASP H 1.0 0.0 6.5 628 483 A 21 ASP H A 20 LYS HD2 1.0 0.0 6.5 629 484 A 21 ASP H A 20 LYS HD3 1.0 0.0 6.5 630 485 A 21 ASP H A 20 LYS HG2 1.0 0.0 6.5 631 486 A 21 ASP H A 20 LYS HG3 1.0 0.0 6.5 632 487 A 21 ASP H A 20 LYS HE2 1.0 0.0 6.5 633 487 A 21 ASP H A 20 LYS HE3 1.0 0.0 6.5 634 488 A 20 LYS HG3 A 21 ASP HB2 1.0 0.0 6.5 635 488 A 20 LYS HG2 A 21 ASP HB2 1.0 0.0 6.5 636 488 A 21 ASP HB3 A 20 LYS HG3 1.0 0.0 6.5 637 488 A 20 LYS HG2 A 21 ASP HB3 1.0 0.0 6.5 638 489 A 21 ASP H A 21 ASP HB2 1.0 0.0 6.5 639 490 A 21 ASP H A 21 ASP HB3 1.0 0.0 6.5 640 491 A 21 ASP H A 22 LYS H 1.0 0.0 5.5 641 492 A 21 ASP H A 22 LYS HA 1.0 0.0 6.5 642 493 A 21 ASP H A 23 LYS H 1.0 0.0 6.5 643 494 A 22 LYS H A 21 ASP HB2 1.0 0.0 6.5 644 495 A 22 LYS H A 21 ASP HB3 1.0 0.0 6.5 645 496 A 22 LYS H A 22 LYS HD2 1.0 0.0 6.5 646 497 A 22 LYS H A 22 LYS HD3 1.0 0.0 6.5 647 498 A 22 LYS H A 22 LYS HE2 1.0 0.0 6.5 648 499 A 22 LYS H A 22 LYS HE3 1.0 0.0 6.5 649 500 A 22 LYS H A 22 LYS HG2 1.0 0.0 6.5 650 501 A 22 LYS H A 22 LYS HG3 1.0 0.0 6.5 651 502 A 23 LYS H A 22 LYS H 1.0 0.0 6.5 652 503 A 23 LYS H A 22 LYS HA 1.0 0.0 5.5 653 504 A 23 LYS H A 22 LYS HB2 1.0 0.0 6.5 654 505 A 23 LYS H A 22 LYS HB3 1.0 0.0 6.5 655 506 A 22 LYS HE2 A 23 LYS HD2 1.0 0.0 6.5 656 507 A 22 LYS HE2 A 23 LYS HD3 1.0 0.0 6.5 657 508 A 22 LYS HE3 A 23 LYS HD2 1.0 0.0 6.5 658 509 A 22 LYS HE3 A 23 LYS HD3 1.0 0.0 6.5 659 510 A 23 LYS H A 22 LYS HG2 1.0 0.0 6.5 660 511 A 22 LYS HG2 A 23 LYS HD2 1.0 0.0 6.5 661 512 A 22 LYS HG2 A 23 LYS HD3 1.0 0.0 6.5 662 513 A 23 LYS H A 22 LYS HG3 1.0 0.0 6.5 663 514 A 23 LYS HD2 A 22 LYS HG3 1.0 0.0 6.5 664 515 A 22 LYS HG3 A 23 LYS HD3 1.0 0.0 6.5 665 516 A 22 LYS HD2 A 71 PHE HBy 1.0 0.0 6.5 666 516 A 22 LYS HD3 A 71 PHE HBy 1.0 0.0 6.5 667 516 A 71 PHE HBx A 22 LYS HD3 1.0 0.0 6.5 668 516 A 22 LYS HD2 A 71 PHE HBx 1.0 0.0 6.5 669 517 A 23 LYS H A 23 LYS HD2 1.0 0.0 6.5 670 518 A 23 LYS H A 23 LYS HD3 1.0 0.0 6.5 671 519 A 23 LYS H A 23 LYS HE2 1.0 0.0 6.5 672 520 A 23 LYS H A 23 LYS HE3 1.0 0.0 6.5 673 521 A 23 LYS H A 23 LYS HG2 1.0 0.0 6.5 674 522 A 23 LYS H A 23 LYS HG3 1.0 0.0 6.5 675 523 A 24 HIS H A 23 LYS H 1.0 0.0 5.5 676 524 A 24 HIS H A 23 LYS HA 1.0 0.0 5.5 677 525 A 24 HIS H A 23 LYS HB2 1.0 0.0 6.5 678 526 A 24 HIS H A 23 LYS HB3 1.0 0.0 6.5 679 527 A 24 HIS H A 23 LYS HG2 1.0 0.0 6.5 680 528 A 24 HIS H A 23 LYS HG3 1.0 0.0 6.5 681 529 A 24 HIS HA A 23 LYS HD3 1.0 0.0 6.5 682 529 A 24 HIS HA A 23 LYS HD2 1.0 0.0 6.5 683 530 A 24 HIS H A 24 HIS HD2 1.0 0.0 6.5 684 531 A 24 HIS H A 25 ARG H 1.0 0.0 6.5 685 532 A 24 HIS H A 25 ARG HA 1.0 0.0 6.5 686 533 A 25 ARG H A 24 HIS HB2 1.0 0.0 6.5 687 534 A 26 TYR H A 24 HIS HB2 1.0 0.0 6.5 688 535 A 27 VAL HGx% A 24 HIS HB2 1.0 0.0 6.5 689 536 A 24 HIS HB2 A 27 VAL HGy% 1.0 0.0 6.5 690 537 A 24 HIS HB3 A 25 ARG H 1.0 0.0 6.5 691 538 A 24 HIS HB3 A 26 TYR H 1.0 0.0 6.5 692 539 A 27 VAL HGx% A 24 HIS HB3 1.0 0.0 6.5 693 540 A 24 HIS HB3 A 27 VAL HGy% 1.0 0.0 6.5 694 541 A 24 HIS HB3 A 27 VAL HGy% 1.0 0.0 6.5 695 541 A 24 HIS HB2 A 27 VAL HGy% 1.0 0.0 6.5 696 541 A 27 VAL HGx% A 24 HIS HB2 1.0 0.0 6.5 697 541 A 27 VAL HGx% A 24 HIS HB3 1.0 0.0 6.5 698 542 A 25 ARG H A 25 ARG HD2 1.0 0.0 6.5 699 543 A 25 ARG H A 25 ARG HD3 1.0 0.0 6.5 700 544 A 25 ARG H A 25 ARG HG2 1.0 0.0 6.5 701 545 A 25 ARG H A 25 ARG HG3 1.0 0.0 6.5 702 546 A 25 ARG H A 26 TYR H 1.0 0.0 6.5 703 547 A 25 ARG H A 45 ARG HA 1.0 0.0 6.5 704 548 A 26 TYR H A 25 ARG HB2 1.0 0.0 6.5 705 549 A 70 ASP H A 25 ARG HB2 1.0 0.0 6.5 706 550 A 26 TYR H A 25 ARG HB3 1.0 0.0 6.5 707 551 A 25 ARG HB3 A 47 ALA HB% 1.0 0.0 6.5 708 552 A 70 ASP H A 25 ARG HB3 1.0 0.0 6.5 709 553 A 26 TYR H A 25 ARG HD2 1.0 0.0 6.5 710 554 A 26 TYR H A 25 ARG HD3 1.0 0.0 6.5 711 555 A 26 TYR H A 25 ARG HG2 1.0 0.0 6.5 712 556 A 25 ARG HG2 A 45 ARG HA 1.0 0.0 6.5 713 557 A 70 ASP H A 25 ARG HG2 1.0 0.0 6.5 714 558 A 26 TYR H A 25 ARG HG3 1.0 0.0 6.5 715 559 A 25 ARG HG3 A 45 ARG HA 1.0 0.0 6.5 716 560 A 70 ASP H A 25 ARG HG3 1.0 0.0 6.5 717 561 A 25 ARG HD2 A 71 PHE HBy 1.0 0.0 6.5 718 561 A 25 ARG HD3 A 71 PHE HBy 1.0 0.0 6.5 719 561 A 71 PHE HBx A 25 ARG HD3 1.0 0.0 6.5 720 561 A 71 PHE HBx A 25 ARG HD2 1.0 0.0 6.5 721 562 A 26 TYR H A 26 TYR HD1 1.0 0.0 6.5 722 563 A 26 TYR H A 26 TYR HD2 1.0 0.0 6.5 723 564 A 26 TYR H A 27 VAL H 1.0 0.0 6.5 724 565 A 26 TYR H A 42 VAL HGy% 1.0 0.0 6.5 725 565 A 42 VAL HGx% A 26 TYR H 1.0 0.0 6.5 726 566 A 26 TYR H A 43 ALA H 1.0 0.0 6.5 727 567 A 26 TYR H A 43 ALA HA 1.0 0.0 6.5 728 568 A 26 TYR H A 43 ALA O 1.0 0.0 4.5 729 569 A 26 TYR H A 43 ALA HB% 1.0 0.0 6.5 730 570 A 26 TYR H A 44 ASP HBy 1.0 0.0 6.5 731 570 A 26 TYR H A 44 ASP HBx 1.0 0.0 6.5 732 571 A 26 TYR HA A 44 ASP HA 1.0 0.0 6.5 733 572 A 26 TYR HA A 68 LEU H 1.0 0.0 6.5 734 573 A 26 TYR HA A 69 PHE HA 1.0 0.0 6.5 735 574 A 70 ASP H A 26 TYR HA 1.0 0.0 6.5 736 575 A 27 VAL H A 26 TYR HBy 1.0 0.0 6.5 737 576 A 70 ASP H A 26 TYR HBy 1.0 0.0 6.5 738 577 A 27 VAL H A 26 TYR HBx 1.0 0.0 6.5 739 578 A 70 ASP H A 26 TYR HBx 1.0 0.0 6.5 740 579 A 26 TYR HD2 A 43 ALA H 1.0 0.0 6.5 741 580 A 43 ALA O A 26 TYR N 1.0 0.0 4.5 742 581 A 43 ALA H A 26 TYR O 1.0 0.0 4.0 743 582 A 26 TYR O A 43 ALA N 1.0 0.0 4.5 744 583 A 44 ASP HA A 26 TYR HBy 1.0 0.0 6.5 745 583 A 44 ASP HA A 26 TYR HBx 1.0 0.0 6.5 746 584 A 70 ASP H A 26 TYR HBy 1.0 0.0 6.5 747 584 A 70 ASP H A 26 TYR HBx 1.0 0.0 6.5 748 585 A 27 VAL HB A 27 VAL H 1.0 0.0 6.5 749 586 A 27 VAL HGx% A 27 VAL H 1.0 0.0 6.5 750 587 A 27 VAL H A 27 VAL HGy% 1.0 0.0 6.5 751 588 A 27 VAL H A 27 VAL HGy% 1.0 0.0 6.5 752 588 A 27 VAL HGx% A 27 VAL H 1.0 0.0 6.5 753 589 A 27 VAL H A 28 ILE H 1.0 0.0 6.5 754 590 A 27 VAL H A 68 LEU H 1.0 0.0 6.5 755 591 A 27 VAL H A 68 LEU O 1.0 0.0 4.5 756 592 A 27 VAL H A 69 PHE HA 1.0 0.0 6.5 757 593 A 27 VAL H A 69 PHE HB2 1.0 0.0 6.5 758 594 A 27 VAL HA A 28 ILE H 1.0 0.0 5.5 759 595 A 27 VAL HA A 42 VAL HA 1.0 0.0 5.5 760 596 A 27 VAL HA A 42 VAL HB 1.0 0.0 6.5 761 597 A 42 VAL HGx% A 27 VAL HA 1.0 0.0 6.5 762 598 A 27 VAL HA A 42 VAL HGy% 1.0 0.0 6.5 763 599 A 27 VAL HA A 42 VAL HGy% 1.0 0.0 6.5 764 599 A 42 VAL HGx% A 27 VAL HA 1.0 0.0 6.5 765 600 A 27 VAL HA A 43 ALA H 1.0 0.0 6.5 766 601 A 27 VAL HB A 28 ILE H 1.0 0.0 6.5 767 602 A 27 VAL HB A 42 VAL HA 1.0 0.0 6.5 768 603 A 42 VAL HGx% A 27 VAL HB 1.0 0.0 6.5 769 604 A 27 VAL HB A 42 VAL HGy% 1.0 0.0 6.5 770 605 A 27 VAL HB A 42 VAL HGy% 1.0 0.0 6.5 771 605 A 42 VAL HGx% A 27 VAL HB 1.0 0.0 6.5 772 606 A 27 VAL HB A 43 ALA H 1.0 0.0 6.5 773 607 A 27 VAL HB A 68 LEU H 1.0 0.0 6.5 774 608 A 27 VAL HB A 68 LEU HB2 1.0 0.0 6.5 775 609 A 27 VAL HB A 68 LEU HB3 1.0 0.0 6.5 776 610 A 68 LEU O A 27 VAL N 1.0 0.0 4.5 777 611 A 68 LEU H A 27 VAL O 1.0 0.0 4.5 778 612 A 27 VAL O A 68 LEU N 1.0 0.0 4.5 779 613 A 27 VAL HGx% A 28 ILE H 1.0 0.0 6.5 780 614 A 27 VAL HGx% A 43 ALA H 1.0 0.0 6.5 781 615 A 27 VAL HGx% A 68 LEU H 1.0 0.0 6.5 782 616 A 28 ILE H A 27 VAL HGy% 1.0 0.0 6.5 783 617 A 43 ALA H A 27 VAL HGy% 1.0 0.0 6.5 784 618 A 68 LEU H A 27 VAL HGy% 1.0 0.0 6.5 785 619 A 29 PHE HA A 27 VAL HGy% 1.0 0.0 6.5 786 619 A 27 VAL HGx% A 29 PHE HA 1.0 0.0 6.5 787 620 A 41 THR H A 27 VAL HGy% 1.0 0.0 6.5 788 620 A 27 VAL HGx% A 41 THR H 1.0 0.0 6.5 789 621 A 41 THR HG2% A 27 VAL HGy% 1.0 0.0 6.5 790 621 A 27 VAL HGx% A 41 THR HG2% 1.0 0.0 6.5 791 622 A 27 VAL HGy% A 42 VAL HGy% 1.0 0.0 6.5 792 622 A 27 VAL HGx% A 42 VAL HGy% 1.0 0.0 6.5 793 622 A 42 VAL HGx% A 27 VAL HGy% 1.0 0.0 6.5 794 622 A 42 VAL HGx% A 27 VAL HGx% 1.0 0.0 6.5 795 623 A 43 ALA H A 27 VAL HGy% 1.0 0.0 6.5 796 623 A 27 VAL HGx% A 43 ALA H 1.0 0.0 6.5 797 624 A 68 LEU HA A 27 VAL HGy% 1.0 0.0 6.5 798 624 A 27 VAL HGx% A 68 LEU HA 1.0 0.0 6.5 799 625 A 27 VAL HGy% A 68 LEU HB3 1.0 0.0 6.5 800 625 A 27 VAL HGx% A 68 LEU HB3 1.0 0.0 6.5 801 625 A 68 LEU HB2 A 27 VAL HGy% 1.0 0.0 6.5 802 625 A 27 VAL HGx% A 68 LEU HB2 1.0 0.0 6.5 803 626 A 28 ILE H A 28 ILE HB 1.0 0.0 6.5 804 627 A 28 ILE H A 28 ILE HG12 1.0 0.0 6.5 805 628 A 28 ILE H A 28 ILE HG13 1.0 0.0 6.5 806 629 A 28 ILE H A 28 ILE HD1% 1.0 0.0 6.5 807 630 A 28 ILE H A 28 ILE HG2% 1.0 0.0 6.5 808 631 A 28 ILE H A 29 PHE H 1.0 0.0 6.5 809 632 A 28 ILE H A 41 THR H 1.0 0.0 6.5 810 633 A 28 ILE H A 41 THR HA 1.0 0.0 6.5 811 634 A 28 ILE H A 41 THR HB 1.0 0.0 6.5 812 635 A 28 ILE H A 41 THR O 1.0 0.0 4.0 813 636 A 28 ILE H A 41 THR HG2% 1.0 0.0 6.5 814 637 A 42 VAL HA A 28 ILE H 1.0 0.0 6.5 815 638 A 28 ILE H A 42 VAL HB 1.0 0.0 6.5 816 639 A 43 ALA H A 28 ILE H 1.0 0.0 6.5 817 640 A 29 PHE H A 28 ILE HA 1.0 0.0 5.5 818 641 A 41 THR HB A 28 ILE HA 1.0 0.0 6.5 819 642 A 41 THR HG2% A 28 ILE HA 1.0 0.0 6.5 820 643 A 28 ILE HA A 42 VAL HGy% 1.0 0.0 6.5 821 643 A 42 VAL HGx% A 28 ILE HA 1.0 0.0 6.5 822 644 A 28 ILE HA A 56 ILE HG2% 1.0 0.0 6.5 823 645 A 28 ILE HA A 67 GLY HAy 1.0 0.0 6.5 824 646 A 28 ILE HA A 67 GLY HAx 1.0 0.0 6.5 825 647 A 28 ILE HA A 67 GLY HAy 1.0 0.0 5.5 826 647 A 28 ILE HA A 67 GLY HAx 1.0 0.0 5.5 827 648 A 68 LEU H A 28 ILE HA 1.0 0.0 6.5 828 649 A 28 ILE HB A 29 PHE H 1.0 0.0 6.5 829 650 A 41 THR H A 28 ILE HB 1.0 0.0 6.5 830 651 A 28 ILE HB A 56 ILE HG2% 1.0 0.0 6.5 831 652 A 29 PHE H A 28 ILE HG12 1.0 0.0 6.5 832 653 A 56 ILE HB A 28 ILE HG12 1.0 0.0 6.5 833 654 A 56 ILE HG2% A 28 ILE HG12 1.0 0.0 6.5 834 655 A 29 PHE H A 28 ILE HG13 1.0 0.0 6.5 835 656 A 56 ILE HB A 28 ILE HG13 1.0 0.0 6.5 836 657 A 56 ILE HG2% A 28 ILE HG13 1.0 0.0 6.5 837 658 A 41 THR O A 28 ILE N 1.0 0.0 4.5 838 659 A 41 THR H A 28 ILE O 1.0 0.0 4.5 839 660 A 28 ILE O A 41 THR N 1.0 0.0 4.5 840 661 A 28 ILE HD1% A 29 PHE H 1.0 0.0 6.5 841 662 A 28 ILE HD1% A 56 ILE H 1.0 0.0 6.5 842 663 A 28 ILE HG12 A 56 ILE HG13 1.0 0.0 5.5 843 663 A 56 ILE HG12 A 28 ILE HG13 1.0 0.0 5.5 844 663 A 28 ILE HG12 A 56 ILE HG12 1.0 0.0 5.5 845 663 A 28 ILE HG13 A 56 ILE HG13 1.0 0.0 5.5 846 664 A 28 ILE HG2% A 29 PHE H 1.0 0.0 6.5 847 665 A 28 ILE HG2% A 30 TYR H 1.0 0.0 6.5 848 666 A 41 THR H A 28 ILE HG2% 1.0 0.0 6.5 849 667 A 28 ILE HG2% A 42 VAL HGy% 1.0 0.0 6.5 850 667 A 42 VAL HGx% A 28 ILE HG2% 1.0 0.0 6.5 851 668 A 28 ILE HG2% A 56 ILE H 1.0 0.0 6.5 852 669 A 28 ILE HG2% A 56 ILE HG2% 1.0 0.0 6.5 853 670 A 28 ILE HG2% A 65 ARG H 1.0 0.0 6.5 854 671 A 28 ILE HG2% A 66 TYR H 1.0 0.0 6.5 855 672 A 29 PHE H A 29 PHE HDx 1.0 0.0 6.5 856 673 A 29 PHE H A 29 PHE HDy 1.0 0.0 6.5 857 674 A 29 PHE H A 29 PHE HEx 1.0 0.0 6.5 858 675 A 29 PHE H A 29 PHE HEy 1.0 0.0 6.5 859 676 A 29 PHE H A 66 TYR H 1.0 0.0 6.5 860 677 A 29 PHE H A 66 TYR HBy 1.0 0.0 6.5 861 678 A 29 PHE H A 66 TYR HBx 1.0 0.0 6.5 862 679 A 29 PHE H A 66 TYR O 1.0 0.0 4.0 863 680 A 29 PHE H A 66 TYR HBy 1.0 0.0 6.5 864 680 A 29 PHE H A 66 TYR HBx 1.0 0.0 6.5 865 681 A 29 PHE H A 67 GLY HAy 1.0 0.0 6.5 866 682 A 29 PHE H A 67 GLY HAx 1.0 0.0 6.5 867 683 A 29 PHE H A 67 GLY HAy 1.0 0.0 6.5 868 683 A 29 PHE H A 67 GLY HAx 1.0 0.0 6.5 869 684 A 29 PHE HA A 114 LEU HDy% 1.0 0.0 6.5 870 684 A 114 LEU HDx% A 29 PHE HA 1.0 0.0 6.5 871 685 A 29 PHE HA A 30 TYR H 1.0 0.0 5.5 872 686 A 39 VAL H A 29 PHE HA 1.0 0.0 6.5 873 687 A 29 PHE HA A 39 VAL HA 1.0 0.0 5.5 874 688 A 29 PHE HA A 39 VAL HGy% 1.0 0.0 6.5 875 688 A 39 VAL HGx% A 29 PHE HA 1.0 0.0 6.5 876 689 A 29 PHE HA A 41 THR H 1.0 0.0 6.5 877 690 A 30 TYR H A 29 PHE HBy 1.0 0.0 6.5 878 691 A 66 TYR H A 29 PHE HBy 1.0 0.0 6.5 879 692 A 30 TYR H A 29 PHE HBx 1.0 0.0 6.5 880 693 A 66 TYR H A 29 PHE HBx 1.0 0.0 6.5 881 694 A 39 VAL H A 29 PHE HDx 1.0 0.0 6.5 882 695 A 40 GLU H A 29 PHE HDx 1.0 0.0 6.5 883 696 A 66 TYR H A 29 PHE HDy 1.0 0.0 6.5 884 697 A 68 LEU H A 29 PHE HDy 1.0 0.0 6.5 885 698 A 66 TYR H A 29 PHE HEy 1.0 0.0 6.5 886 699 A 68 LEU H A 29 PHE HEy 1.0 0.0 6.5 887 700 A 66 TYR O A 29 PHE N 1.0 0.0 4.5 888 701 A 66 TYR H A 29 PHE O 1.0 0.0 4.0 889 702 A 29 PHE O A 66 TYR N 1.0 0.0 4.5 890 703 A 29 PHE HBx A 114 LEU HDy% 1.0 0.0 6.5 891 703 A 29 PHE HBy A 114 LEU HDy% 1.0 0.0 6.5 892 703 A 114 LEU HDx% A 29 PHE HBy 1.0 0.0 6.5 893 703 A 114 LEU HDx% A 29 PHE HBx 1.0 0.0 6.5 894 704 A 30 TYR H A 29 PHE HBy 1.0 0.0 6.5 895 704 A 30 TYR H A 29 PHE HBx 1.0 0.0 6.5 896 705 A 41 THR H A 29 PHE HBy 1.0 0.0 6.5 897 705 A 41 THR H A 29 PHE HBx 1.0 0.0 6.5 898 706 A 66 TYR H A 29 PHE HBy 1.0 0.0 6.5 899 706 A 66 TYR H A 29 PHE HBx 1.0 0.0 6.5 900 707 A 30 TYR H A 30 TYR HD1 1.0 0.0 6.5 901 708 A 30 TYR H A 30 TYR HD2 1.0 0.0 6.5 902 709 A 30 TYR H A 31 ILE H 1.0 0.0 6.5 903 710 A 38 ASP H A 30 TYR H 1.0 0.0 6.5 904 711 A 38 ASP HA A 30 TYR H 1.0 0.0 6.5 905 712 A 30 TYR H A 38 ASP O 1.0 0.0 4.0 906 713 A 30 TYR H A 38 ASP HBy 1.0 0.0 6.5 907 713 A 38 ASP HBx A 30 TYR H 1.0 0.0 6.5 908 714 A 30 TYR H A 39 VAL HA 1.0 0.0 6.5 909 715 A 39 VAL HB A 30 TYR H 1.0 0.0 6.5 910 716 A 30 TYR H A 39 VAL HGy% 1.0 0.0 6.5 911 716 A 39 VAL HGx% A 30 TYR H 1.0 0.0 6.5 912 717 A 30 TYR H A 40 GLU HA 1.0 0.0 6.5 913 718 A 30 TYR H A 40 GLU HB2 1.0 0.0 6.5 914 719 A 30 TYR H A 40 GLU HB3 1.0 0.0 6.5 915 720 A 40 GLU HG2 A 30 TYR H 1.0 0.0 6.5 916 721 A 40 GLU HG3 A 30 TYR H 1.0 0.0 6.5 917 722 A 40 GLU HG2 A 30 TYR HA 1.0 0.0 6.5 918 723 A 40 GLU HG3 A 30 TYR HA 1.0 0.0 6.5 919 724 A 66 TYR H A 30 TYR HA 1.0 0.0 6.5 920 725 A 31 ILE H A 30 TYR HB2 1.0 0.0 6.5 921 726 A 66 TYR H A 30 TYR HB2 1.0 0.0 6.5 922 727 A 31 ILE H A 30 TYR HB3 1.0 0.0 6.5 923 728 A 38 ASP O A 30 TYR N 1.0 0.0 4.5 924 729 A 38 ASP H A 30 TYR O 1.0 0.0 4.5 925 730 A 30 TYR O A 38 ASP N 1.0 0.0 4.5 926 731 A 31 ILE H A 31 ILE HG12 1.0 0.0 6.5 927 732 A 31 ILE H A 31 ILE HG13 1.0 0.0 6.5 928 733 A 31 ILE H A 31 ILE HD1% 1.0 0.0 6.5 929 734 A 31 ILE H A 31 ILE HG2% 1.0 0.0 6.5 930 735 A 31 ILE H A 32 ARG H 1.0 0.0 6.5 931 736 A 31 ILE H A 65 ARG HA 1.0 0.0 6.5 932 737 A 31 ILE HA A 106 LEU HDy% 1.0 0.0 6.5 933 737 A 31 ILE HA A 106 LEU HDx% 1.0 0.0 6.5 934 738 A 31 ILE HA A 107 TYR HA 1.0 0.0 6.5 935 739 A 37 ILE H A 31 ILE HA 1.0 0.0 6.5 936 740 A 38 ASP H A 31 ILE HA 1.0 0.0 6.5 937 741 A 32 ARG H A 31 ILE HB 1.0 0.0 6.5 938 742 A 38 ASP HBx A 31 ILE HB 1.0 0.0 6.5 939 743 A 31 ILE HB A 38 ASP HBy 1.0 0.0 6.5 940 743 A 38 ASP HBx A 31 ILE HB 1.0 0.0 6.5 941 744 A 106 LEU HA A 31 ILE HG12 1.0 0.0 6.5 942 745 A 106 LEU HDx% A 31 ILE HG12 1.0 0.0 6.5 943 746 A 31 ILE HG12 A 106 LEU HDy% 1.0 0.0 6.5 944 747 A 107 TYR H A 31 ILE HG12 1.0 0.0 6.5 945 748 A 110 SER H A 31 ILE HG12 1.0 0.0 6.5 946 749 A 32 ARG H A 31 ILE HG12 1.0 0.0 6.5 947 750 A 106 LEU HA A 31 ILE HG13 1.0 0.0 6.5 948 751 A 106 LEU HDx% A 31 ILE HG13 1.0 0.0 6.5 949 752 A 31 ILE HG13 A 106 LEU HDy% 1.0 0.0 6.5 950 753 A 110 SER H A 31 ILE HG13 1.0 0.0 6.5 951 754 A 32 ARG H A 31 ILE HG13 1.0 0.0 6.5 952 755 A 31 ILE HD1% A 106 LEU H 1.0 0.0 6.5 953 756 A 31 ILE HD1% A 106 LEU HDx% 1.0 0.0 6.5 954 757 A 31 ILE HD1% A 106 LEU HDy% 1.0 0.0 6.5 955 758 A 31 ILE HD1% A 106 LEU HDy% 1.0 0.0 6.5 956 758 A 31 ILE HD1% A 106 LEU HDx% 1.0 0.0 6.5 957 759 A 31 ILE HD1% A 107 TYR H 1.0 0.0 6.5 958 760 A 31 ILE HD1% A 108 SER H 1.0 0.0 6.5 959 761 A 110 SER H A 31 ILE HD1% 1.0 0.0 6.5 960 762 A 31 ILE HD1% A 110 SER HBx 1.0 0.0 6.5 961 762 A 110 SER HBy A 31 ILE HD1% 1.0 0.0 6.5 962 763 A 31 ILE HD1% A 32 ARG H 1.0 0.0 6.5 963 764 A 106 LEU H A 31 ILE HG13 1.0 0.0 6.5 964 764 A 106 LEU H A 31 ILE HG12 1.0 0.0 6.5 965 765 A 31 ILE HG13 A 106 LEU HDy% 1.0 0.0 6.5 966 765 A 31 ILE HG12 A 106 LEU HDy% 1.0 0.0 6.5 967 765 A 106 LEU HDx% A 31 ILE HG13 1.0 0.0 6.5 968 765 A 106 LEU HDx% A 31 ILE HG12 1.0 0.0 6.5 969 766 A 108 SER H A 31 ILE HG13 1.0 0.0 6.5 970 766 A 108 SER H A 31 ILE HG12 1.0 0.0 6.5 971 767 A 37 ILE H A 31 ILE HG13 1.0 0.0 6.5 972 767 A 37 ILE H A 31 ILE HG12 1.0 0.0 6.5 973 768 A 38 ASP H A 31 ILE HG13 1.0 0.0 6.5 974 768 A 38 ASP H A 31 ILE HG12 1.0 0.0 6.5 975 769 A 31 ILE HG2% A 106 LEU HDy% 1.0 0.0 6.5 976 769 A 31 ILE HG2% A 106 LEU HDx% 1.0 0.0 6.5 977 770 A 31 ILE HG2% A 32 ARG H 1.0 0.0 6.5 978 771 A 31 ILE HG2% A 34 GLU H 1.0 0.0 6.5 979 772 A 35 LYS H A 31 ILE HG2% 1.0 0.0 6.5 980 773 A 36 GLN H A 31 ILE HG2% 1.0 0.0 6.5 981 774 A 38 ASP H A 31 ILE HG2% 1.0 0.0 6.5 982 775 A 32 ARG H A 32 ARG HD2 1.0 0.0 6.5 983 776 A 32 ARG H A 32 ARG HD3 1.0 0.0 6.5 984 777 A 32 ARG H A 32 ARG HGy 1.0 0.0 6.5 985 778 A 32 ARG H A 32 ARG HGx 1.0 0.0 6.5 986 779 A 32 ARG H A 32 ARG HBx 1.0 0.0 6.5 987 779 A 32 ARG H A 32 ARG HBy 1.0 0.0 6.5 988 780 A 32 ARG H A 32 ARG HGy 1.0 0.0 6.5 989 780 A 32 ARG H A 32 ARG HGx 1.0 0.0 6.5 990 781 A 32 ARG H A 33 ASP H 1.0 0.0 6.5 991 782 A 35 LYS H A 32 ARG H 1.0 0.0 6.5 992 783 A 36 GLN H A 32 ARG H 1.0 0.0 6.5 993 784 A 32 ARG H A 36 GLN O 1.0 0.0 4.0 994 785 A 32 ARG H A 37 ILE HA 1.0 0.0 6.5 995 786 A 37 ILE HB A 32 ARG H 1.0 0.0 6.5 996 787 A 37 ILE HG12 A 32 ARG H 1.0 0.0 6.5 997 788 A 37 ILE HG13 A 32 ARG H 1.0 0.0 6.5 998 789 A 32 ARG H A 37 ILE HD1% 1.0 0.0 6.5 999 790 A 37 ILE HG2% A 32 ARG H 1.0 0.0 6.5 1000 791 A 38 ASP H A 32 ARG H 1.0 0.0 6.5 1001 792 A 38 ASP HA A 32 ARG H 1.0 0.0 6.5 1002 793 A 32 ARG H A 38 ASP HBy 1.0 0.0 6.5 1003 794 A 38 ASP HBx A 32 ARG H 1.0 0.0 6.5 1004 795 A 32 ARG H A 38 ASP HBy 1.0 0.0 6.5 1005 795 A 38 ASP HBx A 32 ARG H 1.0 0.0 6.5 1006 796 A 35 LYS H A 32 ARG HA 1.0 0.0 6.5 1007 797 A 32 ARG HBy A 33 ASP H 1.0 0.0 6.5 1008 798 A 33 ASP H A 32 ARG HBx 1.0 0.0 6.5 1009 799 A 37 ILE HB A 32 ARG HD2 1.0 0.0 6.5 1010 800 A 37 ILE HG2% A 32 ARG HD2 1.0 0.0 6.5 1011 801 A 37 ILE HB A 32 ARG HD3 1.0 0.0 6.5 1012 802 A 37 ILE HG2% A 32 ARG HD3 1.0 0.0 6.5 1013 803 A 33 ASP H A 32 ARG HGy 1.0 0.0 6.5 1014 804 A 32 ARG HGx A 33 ASP H 1.0 0.0 6.5 1015 805 A 36 GLN O A 32 ARG N 1.0 0.0 4.5 1016 806 A 36 GLN H A 32 ARG O 1.0 0.0 4.0 1017 807 A 32 ARG O A 36 GLN N 1.0 0.0 4.5 1018 808 A 35 LYS H A 32 ARG HBx 1.0 0.0 6.5 1019 808 A 35 LYS H A 32 ARG HBy 1.0 0.0 6.5 1020 809 A 33 ASP H A 32 ARG HGy 1.0 0.0 6.5 1021 809 A 32 ARG HGx A 33 ASP H 1.0 0.0 6.5 1022 810 A 36 GLN H A 32 ARG HGy 1.0 0.0 6.5 1023 810 A 36 GLN H A 32 ARG HGx 1.0 0.0 6.5 1024 811 A 34 GLU H A 33 ASP H 1.0 0.0 6.5 1025 812 A 34 GLU H A 33 ASP HA 1.0 0.0 6.5 1026 813 A 35 LYS H A 33 ASP HA 1.0 0.0 6.5 1027 814 A 36 GLN H A 33 ASP HA 1.0 0.0 6.5 1028 815 A 34 GLU H A 33 ASP HBy 1.0 0.0 6.5 1029 816 A 35 LYS H A 33 ASP HBy 1.0 0.0 6.5 1030 817 A 35 LYS HD2 A 33 ASP HBy 1.0 0.0 5.5 1031 818 A 33 ASP HBy A 35 LYS HD3 1.0 0.0 5.5 1032 819 A 35 LYS HG2 A 33 ASP HBy 1.0 0.0 6.5 1033 820 A 35 LYS HG3 A 33 ASP HBy 1.0 0.0 6.5 1034 821 A 34 GLU H A 33 ASP HBx 1.0 0.0 6.5 1035 822 A 35 LYS H A 33 ASP HBx 1.0 0.0 6.5 1036 823 A 33 ASP HBx A 35 LYS HD2 1.0 0.0 5.5 1037 824 A 33 ASP HBx A 35 LYS HD3 1.0 0.0 5.5 1038 825 A 35 LYS HG2 A 33 ASP HBx 1.0 0.0 6.5 1039 826 A 35 LYS HG3 A 33 ASP HBx 1.0 0.0 6.5 1040 827 A 34 GLU H A 33 ASP HBy 1.0 0.0 6.5 1041 827 A 34 GLU H A 33 ASP HBx 1.0 0.0 6.5 1042 828 A 35 LYS H A 33 ASP HBy 1.0 0.0 6.5 1043 828 A 35 LYS H A 33 ASP HBx 1.0 0.0 6.5 1044 829 A 33 ASP HBy A 35 LYS HD3 1.0 0.0 5.0 1045 829 A 33 ASP HBx A 35 LYS HD3 1.0 0.0 5.0 1046 829 A 35 LYS HD2 A 33 ASP HBy 1.0 0.0 5.0 1047 829 A 33 ASP HBx A 35 LYS HD2 1.0 0.0 5.0 1048 830 A 34 GLU H A 34 GLU HBy 1.0 0.0 6.5 1049 831 A 34 GLU H A 34 GLU HBx 1.0 0.0 6.5 1050 832 A 34 GLU H A 34 GLU HG2 1.0 0.0 6.5 1051 833 A 34 GLU H A 34 GLU HG3 1.0 0.0 6.5 1052 834 A 34 GLU H A 34 GLU HBx 1.0 0.0 5.5 1053 834 A 34 GLU H A 34 GLU HBy 1.0 0.0 5.5 1054 835 A 35 LYS H A 34 GLU H 1.0 0.0 6.5 1055 836 A 36 GLN H A 34 GLU H 1.0 0.0 6.5 1056 837 A 36 GLN HG2 A 34 GLU H 1.0 0.0 6.5 1057 838 A 34 GLU H A 36 GLN HG3 1.0 0.0 6.5 1058 839 A 34 GLU H A 36 GLN HBx 1.0 0.0 6.5 1059 839 A 36 GLN HBy A 34 GLU H 1.0 0.0 6.5 1060 840 A 35 LYS H A 34 GLU HBy 1.0 0.0 6.5 1061 841 A 35 LYS H A 34 GLU HBx 1.0 0.0 6.5 1062 842 A 35 LYS H A 34 GLU HG2 1.0 0.0 6.5 1063 843 A 36 GLN H A 34 GLU HG2 1.0 0.0 6.5 1064 844 A 35 LYS H A 34 GLU HG3 1.0 0.0 6.5 1065 845 A 36 GLN H A 34 GLU HG3 1.0 0.0 6.5 1066 846 A 35 LYS H A 34 GLU HBx 1.0 0.0 6.5 1067 846 A 35 LYS H A 34 GLU HBy 1.0 0.0 6.5 1068 847 A 34 GLU HBy A 35 LYS HB2 1.0 0.0 6.5 1069 847 A 34 GLU HBx A 35 LYS HB2 1.0 0.0 6.5 1070 847 A 35 LYS HB3 A 34 GLU HBx 1.0 0.0 6.5 1071 847 A 34 GLU HBy A 35 LYS HB3 1.0 0.0 6.5 1072 848 A 36 GLN H A 34 GLU HBx 1.0 0.0 6.5 1073 848 A 36 GLN H A 34 GLU HBy 1.0 0.0 6.5 1074 849 A 35 LYS H A 35 LYS HD2 1.0 0.0 6.5 1075 850 A 35 LYS H A 35 LYS HD3 1.0 0.0 6.5 1076 851 A 35 LYS HE2 A 35 LYS H 1.0 0.0 6.5 1077 852 A 35 LYS HE3 A 35 LYS H 1.0 0.0 6.5 1078 853 A 35 LYS H A 35 LYS HG2 1.0 0.0 6.5 1079 854 A 35 LYS H A 35 LYS HG3 1.0 0.0 6.5 1080 855 A 36 GLN H A 35 LYS H 1.0 0.0 5.5 1081 856 A 36 GLN HA A 35 LYS H 1.0 0.0 6.5 1082 857 A 35 LYS HE2 A 36 GLN H 1.0 0.0 6.5 1083 858 A 35 LYS HE3 A 36 GLN H 1.0 0.0 6.5 1084 859 A 36 GLN H A 35 LYS HG2 1.0 0.0 6.5 1085 860 A 36 GLN H A 35 LYS HG3 1.0 0.0 6.5 1086 861 A 36 GLN H A 36 GLN HBy 1.0 0.0 6.5 1087 862 A 36 GLN H A 36 GLN HBx 1.0 0.0 6.5 1088 863 A 36 GLN H A 36 GLN HG2 1.0 0.0 6.5 1089 864 A 36 GLN H A 36 GLN HG3 1.0 0.0 6.5 1090 865 A 36 GLN H A 36 GLN HBx 1.0 0.0 5.5 1091 865 A 36 GLN H A 36 GLN HBy 1.0 0.0 5.5 1092 866 A 36 GLN H A 37 ILE H 1.0 0.0 6.5 1093 867 A 36 GLN HA A 37 ILE HD1% 1.0 0.0 6.5 1094 868 A 36 GLN HA A 37 ILE HG2% 1.0 0.0 6.5 1095 869 A 36 GLN HG2 A 37 ILE H 1.0 0.0 6.5 1096 870 A 37 ILE H A 36 GLN HG3 1.0 0.0 6.5 1097 871 A 37 ILE H A 36 GLN HBx 1.0 0.0 6.5 1098 871 A 36 GLN HBy A 37 ILE H 1.0 0.0 6.5 1099 872 A 38 ASP HA A 36 GLN HBx 1.0 0.0 6.5 1100 872 A 36 GLN HBy A 38 ASP HA 1.0 0.0 6.5 1101 873 A 36 GLN HBy A 38 ASP HBy 1.0 0.0 6.5 1102 873 A 36 GLN HBx A 38 ASP HBy 1.0 0.0 6.5 1103 873 A 38 ASP HBx A 36 GLN HBx 1.0 0.0 6.5 1104 873 A 36 GLN HBy A 38 ASP HBx 1.0 0.0 6.5 1105 874 A 37 ILE HB A 37 ILE H 1.0 0.0 6.5 1106 875 A 37 ILE H A 37 ILE HG12 1.0 0.0 6.5 1107 876 A 37 ILE H A 37 ILE HG13 1.0 0.0 6.5 1108 877 A 37 ILE H A 37 ILE HD1% 1.0 0.0 6.5 1109 878 A 37 ILE HG2% A 37 ILE H 1.0 0.0 6.5 1110 879 A 37 ILE H A 38 ASP H 1.0 0.0 6.5 1111 880 A 38 ASP H A 37 ILE HA 1.0 0.0 5.5 1112 881 A 37 ILE HB A 38 ASP H 1.0 0.0 6.5 1113 882 A 37 ILE HB A 39 VAL HGy% 1.0 0.0 6.5 1114 883 A 37 ILE HG12 A 38 ASP H 1.0 0.0 6.5 1115 884 A 37 ILE HG13 A 38 ASP H 1.0 0.0 6.5 1116 885 A 38 ASP H A 37 ILE HD1% 1.0 0.0 6.5 1117 886 A 37 ILE HG2% A 38 ASP H 1.0 0.0 6.5 1118 887 A 38 ASP H A 38 ASP HBy 1.0 0.0 6.5 1119 888 A 38 ASP H A 38 ASP HBx 1.0 0.0 6.5 1120 889 A 38 ASP H A 39 VAL H 1.0 0.0 6.5 1121 890 A 38 ASP HA A 39 VAL H 1.0 0.0 5.5 1122 891 A 39 VAL H A 38 ASP HBy 1.0 0.0 6.5 1123 892 A 38 ASP HBx A 39 VAL H 1.0 0.0 6.5 1124 893 A 39 VAL H A 38 ASP HBy 1.0 0.0 6.5 1125 893 A 38 ASP HBx A 39 VAL H 1.0 0.0 6.5 1126 894 A 39 VAL H A 39 VAL HB 1.0 0.0 5.5 1127 895 A 39 VAL H A 39 VAL HGx% 1.0 0.0 6.5 1128 896 A 39 VAL H A 39 VAL HGy% 1.0 0.0 6.5 1129 897 A 39 VAL H A 39 VAL HGy% 1.0 0.0 6.5 1130 897 A 39 VAL H A 39 VAL HGx% 1.0 0.0 6.5 1131 898 A 39 VAL H A 40 GLU H 1.0 0.0 6.5 1132 899 A 41 THR H A 39 VAL HA 1.0 0.0 6.5 1133 900 A 40 GLU H A 39 VAL HB 1.0 0.0 6.5 1134 901 A 42 VAL HGx% A 39 VAL HB 1.0 0.0 6.5 1135 902 A 39 VAL HB A 42 VAL HGy% 1.0 0.0 6.5 1136 903 A 39 VAL HB A 42 VAL HGy% 1.0 0.0 6.5 1137 903 A 42 VAL HGx% A 39 VAL HB 1.0 0.0 6.5 1138 904 A 40 GLU H A 39 VAL HGx% 1.0 0.0 6.5 1139 905 A 39 VAL HGx% A 42 VAL HB 1.0 0.0 6.5 1140 906 A 42 VAL HGx% A 39 VAL HGx% 1.0 0.0 6.5 1141 907 A 39 VAL HGx% A 42 VAL HGy% 1.0 0.0 6.5 1142 908 A 40 GLU H A 39 VAL HGy% 1.0 0.0 6.5 1143 909 A 42 VAL HB A 39 VAL HGy% 1.0 0.0 6.5 1144 910 A 42 VAL HGx% A 39 VAL HGy% 1.0 0.0 6.5 1145 911 A 39 VAL HGy% A 42 VAL HGy% 1.0 0.0 6.5 1146 912 A 40 GLU H A 39 VAL HGy% 1.0 0.0 6.5 1147 912 A 40 GLU H A 39 VAL HGx% 1.0 0.0 6.5 1148 913 A 41 THR H A 39 VAL HGy% 1.0 0.0 6.5 1149 913 A 39 VAL HGx% A 41 THR H 1.0 0.0 6.5 1150 914 A 42 VAL H A 39 VAL HGy% 1.0 0.0 6.5 1151 914 A 39 VAL HGx% A 42 VAL H 1.0 0.0 6.5 1152 915 A 39 VAL HGx% A 42 VAL HGy% 1.0 0.0 6.5 1153 915 A 39 VAL HGy% A 42 VAL HGy% 1.0 0.0 6.5 1154 915 A 42 VAL HGx% A 39 VAL HGy% 1.0 0.0 6.5 1155 915 A 42 VAL HGx% A 39 VAL HGx% 1.0 0.0 6.5 1156 916 A 40 GLU HG2 A 40 GLU H 1.0 0.0 6.5 1157 917 A 40 GLU HG3 A 40 GLU H 1.0 0.0 6.5 1158 918 A 40 GLU H A 41 THR H 1.0 0.0 6.5 1159 919 A 41 THR HA A 40 GLU HA 1.0 0.0 6.5 1160 920 A 41 THR HB A 40 GLU HA 1.0 0.0 6.5 1161 921 A 41 THR H A 40 GLU HB2 1.0 0.0 6.5 1162 922 A 41 THR HB A 40 GLU HB2 1.0 0.0 6.5 1163 923 A 41 THR H A 40 GLU HB3 1.0 0.0 6.5 1164 924 A 41 THR HB A 40 GLU HB3 1.0 0.0 6.5 1165 925 A 40 GLU HG2 A 41 THR H 1.0 0.0 6.5 1166 926 A 40 GLU HG3 A 41 THR H 1.0 0.0 6.5 1167 927 A 41 THR HA A 40 GLU HB3 1.0 0.0 6.5 1168 927 A 41 THR HA A 40 GLU HB2 1.0 0.0 6.5 1169 928 A 41 THR H A 41 THR HB 1.0 0.0 6.5 1170 929 A 41 THR H A 41 THR HG2% 1.0 0.0 6.5 1171 930 A 41 THR H A 42 VAL H 1.0 0.0 6.5 1172 931 A 41 THR HA A 42 VAL H 1.0 0.0 5.5 1173 932 A 41 THR HB A 42 VAL H 1.0 0.0 6.5 1174 933 A 43 ALA HA A 41 THR HG2% 1.0 0.0 6.5 1175 934 A 41 THR HG2% A 55 ASP H 1.0 0.0 6.5 1176 935 A 41 THR HG2% A 56 ILE HD1% 1.0 0.0 6.5 1177 936 A 41 THR HG2% A 56 ILE HG13 1.0 0.0 6.5 1178 936 A 41 THR HG2% A 56 ILE HG12 1.0 0.0 6.5 1179 937 A 42 VAL HB A 42 VAL H 1.0 0.0 6.5 1180 938 A 42 VAL HGx% A 42 VAL H 1.0 0.0 6.5 1181 939 A 42 VAL H A 42 VAL HGy% 1.0 0.0 6.5 1182 940 A 42 VAL H A 42 VAL HGy% 1.0 0.0 6.5 1183 940 A 42 VAL HGx% A 42 VAL H 1.0 0.0 6.5 1184 941 A 43 ALA H A 42 VAL H 1.0 0.0 6.5 1185 942 A 42 VAL HA A 43 ALA H 1.0 0.0 5.5 1186 943 A 43 ALA H A 42 VAL HB 1.0 0.0 6.5 1187 944 A 42 VAL HGx% A 43 ALA H 1.0 0.0 6.5 1188 945 A 43 ALA H A 42 VAL HGy% 1.0 0.0 6.5 1189 946 A 43 ALA H A 42 VAL HGy% 1.0 0.0 6.5 1190 946 A 42 VAL HGx% A 43 ALA H 1.0 0.0 6.5 1191 947 A 43 ALA H A 44 ASP H 1.0 0.0 6.5 1192 948 A 43 ALA HA A 44 ASP H 1.0 0.0 5.5 1193 949 A 47 ALA HB% A 43 ALA HA 1.0 0.0 6.5 1194 950 A 43 ALA HB% A 44 ASP H 1.0 0.0 6.5 1195 951 A 47 ALA HB% A 43 ALA HB% 1.0 0.0 6.5 1196 952 A 43 ALA HB% A 48 GLU H 1.0 0.0 6.5 1197 953 A 44 ASP H A 44 ASP HBy 1.0 0.0 6.5 1198 954 A 44 ASP HBx A 44 ASP H 1.0 0.0 6.5 1199 955 A 44 ASP H A 44 ASP HBy 1.0 0.0 5.5 1200 955 A 44 ASP HBx A 44 ASP H 1.0 0.0 5.5 1201 956 A 44 ASP H A 45 ARG H 1.0 0.0 6.5 1202 957 A 44 ASP H A 46 ASN HB2 1.0 0.0 6.5 1203 958 A 44 ASP H A 46 ASN HB3 1.0 0.0 6.5 1204 959 A 44 ASP HA A 45 ARG H 1.0 0.0 5.5 1205 960 A 44 ASP HA A 46 ASN H 1.0 0.0 6.5 1206 961 A 45 ARG H A 44 ASP HBy 1.0 0.0 6.5 1207 962 A 44 ASP HBx A 45 ARG H 1.0 0.0 6.5 1208 963 A 45 ARG H A 44 ASP HBy 1.0 0.0 5.5 1209 963 A 44 ASP HBx A 45 ARG H 1.0 0.0 5.5 1210 964 A 46 ASN H A 44 ASP HBy 1.0 0.0 6.5 1211 964 A 44 ASP HBx A 46 ASN H 1.0 0.0 6.5 1212 965 A 45 ARG H A 45 ARG HBy 1.0 0.0 6.5 1213 966 A 45 ARG H A 45 ARG HBx 1.0 0.0 6.5 1214 967 A 45 ARG H A 45 ARG HD2 1.0 0.0 6.5 1215 968 A 45 ARG H A 45 ARG HD3 1.0 0.0 6.5 1216 969 A 45 ARG H A 45 ARG HGy 1.0 0.0 6.5 1217 970 A 45 ARG H A 45 ARG HGx 1.0 0.0 6.5 1218 971 A 45 ARG H A 45 ARG HGy 1.0 0.0 6.5 1219 971 A 45 ARG H A 45 ARG HGx 1.0 0.0 6.5 1220 972 A 45 ARG H A 46 ASN H 1.0 0.0 6.5 1221 973 A 46 ASN H A 45 ARG HBy 1.0 0.0 6.5 1222 974 A 46 ASN H A 45 ARG HBx 1.0 0.0 6.5 1223 975 A 46 ASN H A 45 ARG HD2 1.0 0.0 6.5 1224 976 A 46 ASN H A 45 ARG HD3 1.0 0.0 6.5 1225 977 A 46 ASN H A 45 ARG HBx 1.0 0.0 6.5 1226 977 A 46 ASN H A 45 ARG HBy 1.0 0.0 6.5 1227 978 A 46 ASN HB2 A 46 ASN H 1.0 0.0 5.0 1228 979 A 46 ASN HB3 A 46 ASN H 1.0 0.0 5.5 1229 980 A 46 ASN H A 47 ALA H 1.0 0.0 5.5 1230 981 A 47 ALA H A 46 ASN HA 1.0 0.0 6.5 1231 982 A 46 ASN HB2 A 47 ALA H 1.0 0.0 6.5 1232 983 A 46 ASN HB3 A 47 ALA H 1.0 0.0 6.5 1233 984 A 47 ALA HB% A 47 ALA H 1.0 0.0 6.5 1234 985 A 48 GLU H A 47 ALA H 1.0 0.0 6.5 1235 986 A 48 GLU H A 47 ALA HA 1.0 0.0 5.5 1236 987 A 47 ALA HB% A 48 GLU H 1.0 0.0 6.5 1237 988 A 47 ALA HB% A 51 GLN HA 1.0 0.0 6.5 1238 989 A 47 ALA HB% A 51 GLN HGy 1.0 0.0 6.5 1239 990 A 47 ALA HB% A 51 GLN HGx 1.0 0.0 6.5 1240 991 A 47 ALA HB% A 51 GLN HGx 1.0 0.0 6.5 1241 991 A 47 ALA HB% A 51 GLN HGy 1.0 0.0 6.5 1242 992 A 47 ALA HB% A 52 PHE HA 1.0 0.0 6.5 1243 993 A 47 ALA HB% A 52 PHE HB2 1.0 0.0 6.5 1244 994 A 47 ALA HB% A 52 PHE HB3 1.0 0.0 6.5 1245 995 A 48 GLU H A 48 GLU HB2 1.0 0.0 6.5 1246 996 A 48 GLU H A 48 GLU HB3 1.0 0.0 6.5 1247 997 A 48 GLU H A 48 GLU HGy 1.0 0.0 5.5 1248 998 A 48 GLU H A 48 GLU HGx 1.0 0.0 5.5 1249 999 A 48 GLU H A 49 TYR H 1.0 0.0 6.5 1250 1000 A 48 GLU H A 51 GLN H 1.0 0.0 6.5 1251 1001 A 49 TYR H A 48 GLU HA 1.0 0.0 5.5 1252 1002 A 48 GLU HA A 50 ASP H 1.0 0.0 6.5 1253 1003 A 51 GLN H A 48 GLU HA 1.0 0.0 6.5 1254 1004 A 48 GLU HA A 52 PHE H 1.0 0.0 6.5 1255 1005 A 48 GLU HB2 A 49 TYR H 1.0 0.0 6.5 1256 1006 A 48 GLU HB2 A 51 GLN H 1.0 0.0 6.5 1257 1007 A 48 GLU HB3 A 49 TYR H 1.0 0.0 6.5 1258 1008 A 48 GLU HB3 A 51 GLN H 1.0 0.0 6.5 1259 1009 A 49 TYR H A 48 GLU HGy 1.0 0.0 6.5 1260 1010 A 50 ASP H A 48 GLU HGy 1.0 0.0 6.5 1261 1011 A 51 GLN H A 48 GLU HGy 1.0 0.0 6.5 1262 1012 A 49 TYR H A 48 GLU HGx 1.0 0.0 6.5 1263 1013 A 50 ASP H A 48 GLU HGx 1.0 0.0 6.5 1264 1014 A 51 GLN H A 48 GLU HGx 1.0 0.0 6.5 1265 1015 A 49 TYR H A 48 GLU HGx 1.0 0.0 5.5 1266 1015 A 49 TYR H A 48 GLU HGy 1.0 0.0 5.5 1267 1016 A 50 ASP H A 48 GLU HGx 1.0 0.0 5.5 1268 1016 A 50 ASP H A 48 GLU HGy 1.0 0.0 5.5 1269 1017 A 51 GLN H A 48 GLU HGx 1.0 0.0 5.5 1270 1017 A 51 GLN H A 48 GLU HGy 1.0 0.0 5.5 1271 1018 A 48 GLU HGx A 52 PHE HB2 1.0 0.0 6.5 1272 1018 A 48 GLU HGy A 52 PHE HB2 1.0 0.0 6.5 1273 1018 A 52 PHE HB3 A 48 GLU HGx 1.0 0.0 6.5 1274 1018 A 48 GLU HGy A 52 PHE HB3 1.0 0.0 6.5 1275 1019 A 49 TYR H A 135 ARG HBy 1.0 0.0 6.5 1276 1020 A 49 TYR H A 135 ARG HBx 1.0 0.0 6.5 1277 1021 A 49 TYR H A 135 ARG HD2 1.0 0.0 6.5 1278 1022 A 49 TYR H A 135 ARG HD3 1.0 0.0 6.5 1279 1023 A 49 TYR H A 135 ARG HG3 1.0 0.0 6.5 1280 1024 A 49 TYR H A 135 ARG HBx 1.0 0.0 6.5 1281 1024 A 49 TYR H A 135 ARG HBy 1.0 0.0 6.5 1282 1025 A 49 TYR H A 49 TYR HB2 1.0 0.0 6.5 1283 1026 A 49 TYR H A 49 TYR HB3 1.0 0.0 6.5 1284 1027 A 49 TYR H A 49 TYR HD1 1.0 0.0 6.5 1285 1028 A 49 TYR H A 49 TYR HD2 1.0 0.0 6.5 1286 1029 A 49 TYR H A 49 TYR HEx 1.0 0.0 6.5 1287 1030 A 49 TYR H A 49 TYR HEy 1.0 0.0 6.5 1288 1031 A 49 TYR H A 50 ASP H 1.0 0.0 6.5 1289 1032 A 49 TYR H A 51 GLN H 1.0 0.0 6.5 1290 1033 A 49 TYR H A 52 PHE H 1.0 0.0 6.5 1291 1034 A 51 GLN H A 49 TYR HA 1.0 0.0 6.5 1292 1035 A 52 PHE H A 49 TYR HA 1.0 0.0 6.5 1293 1036 A 49 TYR HA A 53 LEU H 1.0 0.0 6.5 1294 1037 A 49 TYR HB2 A 135 ARG H 1.0 0.0 6.5 1295 1038 A 50 ASP H A 49 TYR HB2 1.0 0.0 6.5 1296 1039 A 52 PHE H A 49 TYR HB2 1.0 0.0 6.5 1297 1040 A 49 TYR HB3 A 135 ARG H 1.0 0.0 6.5 1298 1041 A 50 ASP H A 49 TYR HB3 1.0 0.0 6.5 1299 1042 A 52 PHE H A 49 TYR HB3 1.0 0.0 6.5 1300 1043 A 50 ASP H A 135 ARG HD2 1.0 0.0 6.5 1301 1044 A 50 ASP H A 135 ARG HD3 1.0 0.0 6.5 1302 1045 A 50 ASP H A 50 ASP HBy 1.0 0.0 5.5 1303 1046 A 50 ASP H A 50 ASP HBx 1.0 0.0 6.5 1304 1047 A 51 GLN H A 50 ASP H 1.0 0.0 5.5 1305 1048 A 50 ASP H A 52 PHE H 1.0 0.0 6.5 1306 1049 A 51 GLN H A 50 ASP HA 1.0 0.0 6.5 1307 1050 A 52 PHE H A 50 ASP HA 1.0 0.0 6.5 1308 1051 A 53 LEU H A 50 ASP HA 1.0 0.0 6.5 1309 1052 A 50 ASP HA A 53 LEU HB3 1.0 0.0 6.5 1310 1052 A 50 ASP HA A 53 LEU HB2 1.0 0.0 6.5 1311 1053 A 50 ASP HA A 54 GLU H 1.0 0.0 6.5 1312 1054 A 51 GLN H A 50 ASP HBy 1.0 0.0 6.5 1313 1055 A 54 GLU H A 50 ASP HBy 1.0 0.0 6.5 1314 1056 A 51 GLN H A 50 ASP HBx 1.0 0.0 6.5 1315 1057 A 54 GLU H A 50 ASP HBx 1.0 0.0 6.5 1316 1058 A 51 GLN H A 50 ASP HBy 1.0 0.0 5.5 1317 1058 A 51 GLN H A 50 ASP HBx 1.0 0.0 5.5 1318 1059 A 54 GLU H A 50 ASP HBy 1.0 0.0 6.5 1319 1059 A 54 GLU H A 50 ASP HBx 1.0 0.0 6.5 1320 1060 A 51 GLN HGy A 51 GLN H 1.0 0.0 6.5 1321 1061 A 51 GLN H A 51 GLN HGx 1.0 0.0 6.5 1322 1062 A 51 GLN H A 51 GLN HGx 1.0 0.0 5.5 1323 1062 A 51 GLN HGy A 51 GLN H 1.0 0.0 5.5 1324 1063 A 51 GLN H A 52 PHE H 1.0 0.0 6.5 1325 1064 A 52 PHE HA A 51 GLN H 1.0 0.0 6.5 1326 1065 A 51 GLN H A 53 LEU H 1.0 0.0 6.5 1327 1066 A 51 GLN HA A 53 LEU H 1.0 0.0 6.5 1328 1067 A 51 GLN HA A 54 GLU H 1.0 0.0 6.5 1329 1068 A 51 GLN HA A 54 GLU HA 1.0 0.0 6.5 1330 1069 A 51 GLN HA A 54 GLU HB2 1.0 0.0 6.5 1331 1070 A 51 GLN HA A 54 GLU HB3 1.0 0.0 5.5 1332 1071 A 51 GLN HA A 54 GLU HG2 1.0 0.0 6.5 1333 1072 A 51 GLN HA A 54 GLU HG3 1.0 0.0 6.5 1334 1073 A 55 ASP H A 51 GLN HA 1.0 0.0 6.5 1335 1074 A 52 PHE H A 51 GLN HB2 1.0 0.0 6.5 1336 1075 A 52 PHE H A 51 GLN HB3 1.0 0.0 6.5 1337 1076 A 51 GLN HGy A 52 PHE H 1.0 0.0 6.5 1338 1077 A 51 GLN HGy A 54 GLU HB2 1.0 0.0 6.5 1339 1078 A 51 GLN HGy A 54 GLU HB3 1.0 0.0 6.5 1340 1079 A 52 PHE H A 51 GLN HGx 1.0 0.0 6.5 1341 1080 A 54 GLU HB2 A 51 GLN HGx 1.0 0.0 6.5 1342 1081 A 51 GLN HGx A 54 GLU HB3 1.0 0.0 6.5 1343 1082 A 52 PHE H A 51 GLN HGx 1.0 0.0 6.5 1344 1082 A 51 GLN HGy A 52 PHE H 1.0 0.0 6.5 1345 1083 A 51 GLN HGy A 54 GLU HB3 1.0 0.0 6.5 1346 1083 A 51 GLN HGx A 54 GLU HB3 1.0 0.0 6.5 1347 1083 A 54 GLU HB2 A 51 GLN HGx 1.0 0.0 6.5 1348 1083 A 51 GLN HGy A 54 GLU HB2 1.0 0.0 6.5 1349 1084 A 52 PHE H A 52 PHE HB2 1.0 0.0 6.5 1350 1085 A 52 PHE H A 52 PHE HB3 1.0 0.0 6.5 1351 1086 A 52 PHE H A 52 PHE HD1 1.0 0.0 6.5 1352 1087 A 52 PHE H A 52 PHE HD2 1.0 0.0 6.5 1353 1088 A 52 PHE H A 53 LEU H 1.0 0.0 6.5 1354 1089 A 52 PHE H A 54 GLU H 1.0 0.0 6.5 1355 1090 A 55 ASP H A 52 PHE H 1.0 0.0 6.5 1356 1091 A 52 PHE HA A 54 GLU H 1.0 0.0 6.5 1357 1092 A 55 ASP H A 52 PHE HA 1.0 0.0 6.5 1358 1093 A 52 PHE HA A 55 ASP HBy 1.0 0.0 6.5 1359 1093 A 52 PHE HA A 55 ASP HBx 1.0 0.0 6.5 1360 1094 A 56 ILE H A 52 PHE HA 1.0 0.0 6.5 1361 1095 A 53 LEU H A 52 PHE HB2 1.0 0.0 6.5 1362 1096 A 52 PHE HB2 A 55 ASP HBy 1.0 0.0 6.5 1363 1097 A 55 ASP HBx A 52 PHE HB2 1.0 0.0 6.5 1364 1098 A 52 PHE HB3 A 53 LEU H 1.0 0.0 6.5 1365 1099 A 52 PHE HB3 A 55 ASP HBy 1.0 0.0 6.5 1366 1100 A 52 PHE HB3 A 55 ASP HBx 1.0 0.0 6.5 1367 1101 A 53 LEU H A 53 LEU HB2 1.0 0.0 6.5 1368 1102 A 53 LEU H A 53 LEU HB3 1.0 0.0 6.5 1369 1103 A 53 LEU H A 53 LEU HG 1.0 0.0 6.5 1370 1104 A 53 LEU H A 53 LEU HDx% 1.0 0.0 6.5 1371 1105 A 53 LEU H A 53 LEU HDy% 1.0 0.0 6.5 1372 1106 A 53 LEU H A 53 LEU HDy% 1.0 0.0 6.5 1373 1106 A 53 LEU H A 53 LEU HDx% 1.0 0.0 6.5 1374 1107 A 53 LEU H A 54 GLU H 1.0 0.0 6.5 1375 1108 A 55 ASP H A 53 LEU H 1.0 0.0 6.5 1376 1109 A 53 LEU HA A 134 SER HA 1.0 0.0 6.5 1377 1110 A 55 ASP H A 53 LEU HA 1.0 0.0 6.5 1378 1111 A 56 ILE H A 53 LEU HA 1.0 0.0 6.5 1379 1112 A 56 ILE HB A 53 LEU HA 1.0 0.0 6.5 1380 1113 A 53 LEU HA A 57 GLN H 1.0 0.0 6.5 1381 1114 A 53 LEU HB2 A 134 SER HA 1.0 0.0 6.5 1382 1115 A 53 LEU HB2 A 54 GLU H 1.0 0.0 6.5 1383 1116 A 134 SER HA A 53 LEU HB3 1.0 0.0 6.5 1384 1117 A 54 GLU H A 53 LEU HB3 1.0 0.0 6.5 1385 1118 A 54 GLU H A 53 LEU HG 1.0 0.0 6.5 1386 1119 A 53 LEU HDx% A 133 ALA H 1.0 0.0 6.5 1387 1120 A 53 LEU HDx% A 133 ALA HA 1.0 0.0 6.5 1388 1121 A 53 LEU HDx% A 133 ALA HB% 1.0 0.0 6.5 1389 1122 A 53 LEU HDx% A 134 SER H 1.0 0.0 6.5 1390 1123 A 53 LEU HDx% A 134 SER HA 1.0 0.0 6.5 1391 1124 A 135 ARG H A 53 LEU HDx% 1.0 0.0 6.5 1392 1125 A 54 GLU H A 53 LEU HDx% 1.0 0.0 6.5 1393 1126 A 133 ALA H A 53 LEU HDy% 1.0 0.0 6.5 1394 1127 A 133 ALA HA A 53 LEU HDy% 1.0 0.0 6.5 1395 1128 A 133 ALA HB% A 53 LEU HDy% 1.0 0.0 6.5 1396 1129 A 134 SER H A 53 LEU HDy% 1.0 0.0 6.5 1397 1130 A 134 SER HA A 53 LEU HDy% 1.0 0.0 6.5 1398 1131 A 135 ARG H A 53 LEU HDy% 1.0 0.0 6.5 1399 1132 A 54 GLU H A 53 LEU HDy% 1.0 0.0 6.5 1400 1133 A 133 ALA H A 53 LEU HDy% 1.0 0.0 6.5 1401 1133 A 53 LEU HDx% A 133 ALA H 1.0 0.0 6.5 1402 1134 A 133 ALA HA A 53 LEU HDy% 1.0 0.0 6.5 1403 1134 A 53 LEU HDx% A 133 ALA HA 1.0 0.0 6.5 1404 1135 A 133 ALA HB% A 53 LEU HDy% 1.0 0.0 6.5 1405 1135 A 53 LEU HDx% A 133 ALA HB% 1.0 0.0 6.5 1406 1136 A 134 SER H A 53 LEU HDy% 1.0 0.0 6.5 1407 1136 A 53 LEU HDx% A 134 SER H 1.0 0.0 6.5 1408 1137 A 135 ARG H A 53 LEU HDy% 1.0 0.0 6.5 1409 1137 A 135 ARG H A 53 LEU HDx% 1.0 0.0 6.5 1410 1138 A 56 ILE HG2% A 53 LEU HDy% 1.0 0.0 6.5 1411 1138 A 56 ILE HG2% A 53 LEU HDx% 1.0 0.0 6.5 1412 1139 A 54 GLU H A 54 GLU HB2 1.0 0.0 5.5 1413 1140 A 54 GLU H A 54 GLU HB3 1.0 0.0 5.5 1414 1141 A 54 GLU H A 54 GLU HG2 1.0 0.0 6.5 1415 1142 A 54 GLU H A 54 GLU HG3 1.0 0.0 6.5 1416 1143 A 55 ASP H A 54 GLU H 1.0 0.0 6.5 1417 1144 A 56 ILE H A 54 GLU H 1.0 0.0 6.5 1418 1145 A 54 GLU H A 57 GLN H 1.0 0.0 6.5 1419 1146 A 55 ASP H A 54 GLU HA 1.0 0.0 5.5 1420 1147 A 56 ILE H A 54 GLU HA 1.0 0.0 6.5 1421 1148 A 54 GLU HA A 57 GLN H 1.0 0.0 6.5 1422 1149 A 54 GLU HA A 57 GLN HA 1.0 0.0 6.5 1423 1150 A 54 GLU HA A 58 LYS H 1.0 0.0 6.5 1424 1151 A 55 ASP H A 54 GLU HB2 1.0 0.0 6.5 1425 1152 A 55 ASP H A 54 GLU HB3 1.0 0.0 6.5 1426 1153 A 55 ASP H A 54 GLU HG2 1.0 0.0 6.5 1427 1154 A 55 ASP H A 54 GLU HG3 1.0 0.0 6.5 1428 1155 A 56 ILE H A 55 ASP H 1.0 0.0 6.5 1429 1156 A 55 ASP H A 57 GLN H 1.0 0.0 6.5 1430 1157 A 57 GLN H A 55 ASP HA 1.0 0.0 6.5 1431 1158 A 58 LYS H A 55 ASP HA 1.0 0.0 6.5 1432 1159 A 55 ASP HA A 58 LYS HB2 1.0 0.0 6.5 1433 1160 A 55 ASP HA A 58 LYS HB3 1.0 0.0 6.5 1434 1161 A 55 ASP HA A 59 CYS H 1.0 0.0 6.5 1435 1162 A 56 ILE H A 55 ASP HBy 1.0 0.0 6.5 1436 1162 A 56 ILE H A 55 ASP HBx 1.0 0.0 6.5 1437 1163 A 56 ILE H A 56 ILE HG12 1.0 0.0 6.5 1438 1164 A 56 ILE H A 56 ILE HG13 1.0 0.0 6.5 1439 1165 A 56 ILE H A 56 ILE HD1% 1.0 0.0 6.5 1440 1166 A 56 ILE HG2% A 56 ILE H 1.0 0.0 6.5 1441 1167 A 56 ILE H A 57 GLN H 1.0 0.0 6.5 1442 1168 A 56 ILE H A 58 LYS H 1.0 0.0 6.5 1443 1169 A 58 LYS H A 56 ILE HA 1.0 0.0 6.5 1444 1170 A 59 CYS H A 56 ILE HA 1.0 0.0 6.5 1445 1171 A 56 ILE HA A 60 GLY H 1.0 0.0 6.5 1446 1172 A 56 ILE HB A 57 GLN H 1.0 0.0 6.5 1447 1173 A 56 ILE HB A 59 CYS HBy 1.0 0.0 6.5 1448 1174 A 56 ILE HB A 59 CYS HBx 1.0 0.0 6.5 1449 1175 A 56 ILE HG12 A 57 GLN H 1.0 0.0 6.5 1450 1176 A 57 GLN H A 56 ILE HG13 1.0 0.0 6.5 1451 1177 A 56 ILE HD1% A 57 GLN H 1.0 0.0 6.5 1452 1178 A 56 ILE HG2% A 57 GLN H 1.0 0.0 6.5 1453 1179 A 57 GLN H A 130 LEU HDx% 1.0 0.0 6.5 1454 1180 A 57 GLN H A 130 LEU HDy% 1.0 0.0 6.5 1455 1181 A 57 GLN H A 130 LEU HDy% 1.0 0.0 6.5 1456 1181 A 57 GLN H A 130 LEU HDx% 1.0 0.0 6.5 1457 1182 A 57 GLN H A 57 GLN HB2 1.0 0.0 6.5 1458 1183 A 57 GLN H A 57 GLN HB3 1.0 0.0 6.5 1459 1184 A 57 GLN H A 57 GLN HG2 1.0 0.0 6.5 1460 1185 A 57 GLN H A 57 GLN HG3 1.0 0.0 6.5 1461 1186 A 57 GLN H A 58 LYS H 1.0 0.0 5.5 1462 1187 A 57 GLN H A 58 LYS HA 1.0 0.0 6.5 1463 1188 A 57 GLN H A 59 CYS H 1.0 0.0 6.5 1464 1189 A 57 GLN H A 60 GLY H 1.0 0.0 6.5 1465 1190 A 57 GLN HA A 58 LYS H 1.0 0.0 6.5 1466 1191 A 57 GLN HA A 59 CYS H 1.0 0.0 6.5 1467 1192 A 57 GLN HA A 60 GLY H 1.0 0.0 6.5 1468 1193 A 57 GLN HB2 A 130 LEU HA 1.0 0.0 6.5 1469 1194 A 58 LYS H A 57 GLN HB2 1.0 0.0 6.5 1470 1195 A 57 GLN HB3 A 130 LEU HA 1.0 0.0 6.5 1471 1196 A 58 LYS H A 57 GLN HB3 1.0 0.0 6.5 1472 1197 A 58 LYS H A 57 GLN HG2 1.0 0.0 6.5 1473 1198 A 58 LYS H A 57 GLN HG3 1.0 0.0 5.5 1474 1199 A 57 GLN HG3 A 130 LEU HDy% 1.0 0.0 6.5 1475 1199 A 57 GLN HG2 A 130 LEU HDy% 1.0 0.0 6.5 1476 1199 A 130 LEU HDx% A 57 GLN HG3 1.0 0.0 6.5 1477 1199 A 130 LEU HDx% A 57 GLN HG2 1.0 0.0 6.5 1478 1200 A 58 LYS H A 58 LYS HB2 1.0 0.0 6.5 1479 1201 A 58 LYS H A 58 LYS HB3 1.0 0.0 6.5 1480 1202 A 58 LYS H A 58 LYS HD2 1.0 0.0 6.5 1481 1203 A 58 LYS H A 58 LYS HD3 1.0 0.0 6.5 1482 1204 A 58 LYS H A 58 LYS HE2 1.0 0.0 6.5 1483 1205 A 58 LYS H A 58 LYS HE3 1.0 0.0 6.5 1484 1206 A 58 LYS H A 58 LYS HG2 1.0 0.0 6.5 1485 1207 A 58 LYS H A 58 LYS HG3 1.0 0.0 6.5 1486 1208 A 58 LYS H A 59 CYS H 1.0 0.0 5.5 1487 1209 A 58 LYS H A 60 GLY H 1.0 0.0 6.5 1488 1210 A 59 CYS H A 58 LYS HA 1.0 0.0 5.5 1489 1211 A 60 GLY H A 58 LYS HA 1.0 0.0 6.5 1490 1212 A 58 LYS HB2 A 59 CYS H 1.0 0.0 6.5 1491 1213 A 58 LYS HB3 A 59 CYS H 1.0 0.0 6.5 1492 1214 A 59 CYS H A 58 LYS HD2 1.0 0.0 6.5 1493 1215 A 59 CYS H A 58 LYS HD3 1.0 0.0 6.5 1494 1216 A 59 CYS H A 58 LYS HG2 1.0 0.0 6.5 1495 1217 A 59 CYS H A 58 LYS HG3 1.0 0.0 6.5 1496 1218 A 59 CYS H A 59 CYS HBy 1.0 0.0 5.5 1497 1219 A 59 CYS H A 59 CYS HBx 1.0 0.0 5.5 1498 1220 A 59 CYS H A 60 GLY H 1.0 0.0 5.5 1499 1221 A 60 GLY H A 59 CYS HA 1.0 0.0 6.5 1500 1222 A 60 GLY H A 59 CYS HBy 1.0 0.0 6.5 1501 1223 A 60 GLY H A 59 CYS HBx 1.0 0.0 6.5 1502 1224 A 61 PRO HA A 60 GLY HAy 1.0 0.0 6.5 1503 1224 A 60 GLY HAx A 61 PRO HA 1.0 0.0 6.5 1504 1225 A 60 GLY HAx A 61 PRO HG3 1.0 0.0 6.5 1505 1225 A 60 GLY HAy A 61 PRO HG3 1.0 0.0 6.5 1506 1225 A 61 PRO HG2 A 60 GLY HAy 1.0 0.0 6.5 1507 1225 A 60 GLY HAx A 61 PRO HG2 1.0 0.0 6.5 1508 1226 A 61 PRO HA A 62 GLY HAy 1.0 0.0 6.5 1509 1226 A 61 PRO HA A 62 GLY HAx 1.0 0.0 6.5 1510 1227 A 61 PRO HG2 A 62 GLY H 1.0 0.0 5.5 1511 1228 A 62 GLY H A 61 PRO HG3 1.0 0.0 5.5 1512 1229 A 61 PRO HG2 A 62 GLY HAy 1.0 0.0 6.5 1513 1229 A 61 PRO HG3 A 62 GLY HAy 1.0 0.0 6.5 1514 1229 A 62 GLY HAx A 61 PRO HG3 1.0 0.0 6.5 1515 1229 A 61 PRO HG2 A 62 GLY HAx 1.0 0.0 6.5 1516 1230 A 62 GLY H A 63 GLU H 1.0 0.0 6.5 1517 1231 A 62 GLY HAx A 63 GLU HG3 1.0 0.0 6.5 1518 1231 A 63 GLU HG2 A 62 GLY HAy 1.0 0.0 6.5 1519 1231 A 62 GLY HAx A 63 GLU HG2 1.0 0.0 6.5 1520 1231 A 62 GLY HAy A 63 GLU HG3 1.0 0.0 6.5 1521 1232 A 63 GLU H A 63 GLU HB2 1.0 0.0 6.5 1522 1233 A 63 GLU H A 63 GLU HB3 1.0 0.0 6.5 1523 1234 A 63 GLU H A 63 GLU HG2 1.0 0.0 6.5 1524 1235 A 63 GLU H A 63 GLU HG3 1.0 0.0 6.5 1525 1236 A 63 GLU H A 64 CYS H 1.0 0.0 6.5 1526 1237 A 63 GLU H A 95 CYS HBy 1.0 0.0 6.5 1527 1237 A 63 GLU H A 95 CYS HBx 1.0 0.0 6.5 1528 1238 A 63 GLU H A 96 PRO HB2 1.0 0.0 6.5 1529 1239 A 63 GLU H A 96 PRO HB3 1.0 0.0 6.5 1530 1240 A 63 GLU H A 99 ALA HB% 1.0 0.0 6.5 1531 1241 A 63 GLU HB2 A 64 CYS H 1.0 0.0 6.5 1532 1242 A 63 GLU HB3 A 64 CYS H 1.0 0.0 6.5 1533 1243 A 63 GLU HG2 A 64 CYS H 1.0 0.0 6.5 1534 1244 A 64 CYS H A 63 GLU HG3 1.0 0.0 6.5 1535 1245 A 64 CYS H A 64 CYS HBy 1.0 0.0 6.5 1536 1245 A 64 CYS H A 64 CYS HBx 1.0 0.0 6.5 1537 1246 A 65 ARG H A 64 CYS H 1.0 0.0 6.5 1538 1247 A 65 ARG H A 64 CYS HA 1.0 0.0 6.5 1539 1248 A 64 CYS HA A 95 CYS HA 1.0 0.0 6.5 1540 1249 A 65 ARG H A 64 CYS HBy 1.0 0.0 6.5 1541 1250 A 95 CYS HA A 64 CYS HBy 1.0 0.0 6.5 1542 1251 A 65 ARG H A 64 CYS HBx 1.0 0.0 6.5 1543 1252 A 64 CYS HBx A 95 CYS HA 1.0 0.0 6.5 1544 1253 A 94 TRP H A 64 CYS HBy 1.0 0.0 6.5 1545 1253 A 64 CYS HBx A 94 TRP H 1.0 0.0 6.5 1546 1254 A 95 CYS H A 64 CYS HBy 1.0 0.0 6.5 1547 1254 A 64 CYS HBx A 95 CYS H 1.0 0.0 6.5 1548 1255 A 95 CYS HA A 64 CYS HBy 1.0 0.0 5.5 1549 1255 A 64 CYS HBx A 95 CYS HA 1.0 0.0 5.5 1550 1256 A 65 ARG H A 65 ARG HD2 1.0 0.0 6.5 1551 1257 A 65 ARG H A 65 ARG HD3 1.0 0.0 6.5 1552 1258 A 65 ARG H A 65 ARG HG2 1.0 0.0 6.5 1553 1259 A 65 ARG H A 65 ARG HG3 1.0 0.0 6.5 1554 1260 A 65 ARG H A 66 TYR H 1.0 0.0 6.5 1555 1261 A 65 ARG H A 94 TRP H 1.0 0.0 6.5 1556 1262 A 65 ARG H A 94 TRP HA 1.0 0.0 6.5 1557 1263 A 65 ARG H A 94 TRP HB2 1.0 0.0 6.5 1558 1264 A 65 ARG H A 94 TRP HB3 1.0 0.0 6.5 1559 1265 A 65 ARG H A 95 CYS HA 1.0 0.0 6.5 1560 1266 A 65 ARG H A 95 CYS HBy 1.0 0.0 6.5 1561 1266 A 65 ARG H A 95 CYS HBx 1.0 0.0 6.5 1562 1267 A 65 ARG HA A 94 TRP HB2 1.0 0.0 6.5 1563 1268 A 65 ARG HA A 94 TRP HB3 1.0 0.0 6.5 1564 1269 A 66 TYR H A 65 ARG HB2 1.0 0.0 6.5 1565 1270 A 94 TRP H A 65 ARG HB2 1.0 0.0 6.5 1566 1271 A 66 TYR H A 65 ARG HB3 1.0 0.0 6.5 1567 1272 A 94 TRP H A 65 ARG HB3 1.0 0.0 6.5 1568 1273 A 66 TYR H A 65 ARG HG2 1.0 0.0 6.5 1569 1274 A 66 TYR H A 65 ARG HG3 1.0 0.0 6.5 1570 1275 A 66 TYR H A 114 LEU HDy% 1.0 0.0 6.5 1571 1275 A 114 LEU HDx% A 66 TYR H 1.0 0.0 6.5 1572 1276 A 66 TYR H A 66 TYR HD1 1.0 0.0 6.5 1573 1277 A 66 TYR H A 66 TYR HD2 1.0 0.0 6.5 1574 1278 A 66 TYR H A 66 TYR HEy 1.0 0.0 6.5 1575 1279 A 66 TYR H A 67 GLY H 1.0 0.0 6.5 1576 1280 A 67 GLY H A 66 TYR HA 1.0 0.0 6.5 1577 1281 A 66 TYR HA A 91 LEU HDy% 1.0 0.0 6.5 1578 1281 A 66 TYR HA A 91 LEU HDx% 1.0 0.0 6.5 1579 1282 A 66 TYR HA A 93 SER HA 1.0 0.0 6.5 1580 1283 A 94 TRP H A 66 TYR HA 1.0 0.0 6.5 1581 1284 A 67 GLY H A 66 TYR HBy 1.0 0.0 6.5 1582 1285 A 94 TRP H A 66 TYR HBy 1.0 0.0 6.5 1583 1286 A 66 TYR HBx A 67 GLY H 1.0 0.0 6.5 1584 1287 A 66 TYR HBx A 94 TRP H 1.0 0.0 6.5 1585 1288 A 67 GLY H A 66 TYR HBy 1.0 0.0 6.5 1586 1288 A 66 TYR HBx A 67 GLY H 1.0 0.0 6.5 1587 1289 A 66 TYR HBy A 93 SER HBx 1.0 0.0 6.5 1588 1289 A 66 TYR HBx A 93 SER HBx 1.0 0.0 6.5 1589 1289 A 93 SER HBy A 66 TYR HBy 1.0 0.0 6.5 1590 1289 A 66 TYR HBx A 93 SER HBy 1.0 0.0 6.5 1591 1290 A 94 TRP H A 66 TYR HBy 1.0 0.0 6.5 1592 1290 A 66 TYR HBx A 94 TRP H 1.0 0.0 6.5 1593 1291 A 68 LEU H A 67 GLY H 1.0 0.0 6.5 1594 1292 A 67 GLY H A 91 LEU HA 1.0 0.0 6.5 1595 1293 A 67 GLY H A 91 LEU HDx% 1.0 0.0 6.5 1596 1294 A 67 GLY H A 91 LEU HDy% 1.0 0.0 6.5 1597 1295 A 67 GLY H A 91 LEU HDy% 1.0 0.0 6.5 1598 1295 A 67 GLY H A 91 LEU HDx% 1.0 0.0 6.5 1599 1296 A 67 GLY H A 92 MET H 1.0 0.0 6.5 1600 1297 A 67 GLY H A 92 MET HB2 1.0 0.0 6.5 1601 1298 A 67 GLY H A 92 MET HB3 1.0 0.0 6.5 1602 1299 A 67 GLY H A 92 MET HG2 1.0 0.0 6.5 1603 1300 A 67 GLY H A 92 MET HG3 1.0 0.0 6.5 1604 1301 A 67 GLY H A 92 MET O 1.0 0.0 4.0 1605 1302 A 67 GLY H A 93 SER HA 1.0 0.0 6.5 1606 1303 A 67 GLY H A 93 SER HBy 1.0 0.0 6.5 1607 1304 A 67 GLY H A 93 SER HBx 1.0 0.0 6.5 1608 1305 A 67 GLY H A 93 SER HBx 1.0 0.0 6.5 1609 1305 A 67 GLY H A 93 SER HBy 1.0 0.0 6.5 1610 1306 A 94 TRP H A 67 GLY H 1.0 0.0 6.5 1611 1307 A 92 MET O A 67 GLY N 1.0 0.0 4.5 1612 1308 A 92 MET H A 67 GLY O 1.0 0.0 4.0 1613 1309 A 67 GLY O A 92 MET N 1.0 0.0 4.5 1614 1310 A 92 MET H A 67 GLY HAy 1.0 0.0 6.5 1615 1310 A 67 GLY HAx A 92 MET H 1.0 0.0 6.5 1616 1311 A 68 LEU H A 68 LEU HG 1.0 0.0 6.5 1617 1312 A 68 LEU H A 68 LEU HD1% 1.0 0.0 6.5 1618 1313 A 68 LEU H A 68 LEU HD2% 1.0 0.0 6.5 1619 1314 A 68 LEU H A 69 PHE H 1.0 0.0 6.5 1620 1315 A 68 LEU HA A 90 PHE H 1.0 0.0 6.5 1621 1316 A 68 LEU HA A 91 LEU HA 1.0 0.0 5.5 1622 1317 A 68 LEU HA A 91 LEU HDx% 1.0 0.0 6.5 1623 1318 A 68 LEU HA A 91 LEU HDy% 1.0 0.0 6.5 1624 1319 A 68 LEU HA A 91 LEU HDy% 1.0 0.0 6.5 1625 1319 A 68 LEU HA A 91 LEU HDx% 1.0 0.0 6.5 1626 1320 A 68 LEU HA A 92 MET H 1.0 0.0 5.5 1627 1321 A 68 LEU HB2 A 118 LEU HA 1.0 0.0 6.5 1628 1322 A 118 LEU HB2 A 68 LEU HB2 1.0 0.0 6.5 1629 1323 A 68 LEU HB2 A 118 LEU HB3 1.0 0.0 6.5 1630 1324 A 68 LEU HB2 A 69 PHE H 1.0 0.0 6.5 1631 1325 A 68 LEU HB2 A 91 LEU HDx% 1.0 0.0 6.5 1632 1326 A 68 LEU HB2 A 91 LEU HDy% 1.0 0.0 6.5 1633 1327 A 118 LEU HA A 68 LEU HB3 1.0 0.0 6.5 1634 1328 A 118 LEU HB2 A 68 LEU HB3 1.0 0.0 6.5 1635 1329 A 68 LEU HB3 A 118 LEU HB3 1.0 0.0 6.5 1636 1330 A 69 PHE H A 68 LEU HB3 1.0 0.0 6.5 1637 1331 A 91 LEU HDx% A 68 LEU HB3 1.0 0.0 6.5 1638 1332 A 68 LEU HB3 A 91 LEU HDy% 1.0 0.0 6.5 1639 1333 A 68 LEU HG A 69 PHE H 1.0 0.0 6.5 1640 1334 A 68 LEU HB3 A 118 LEU HDy% 1.0 0.0 6.5 1641 1334 A 68 LEU HB2 A 118 LEU HDy% 1.0 0.0 6.5 1642 1334 A 118 LEU HDx% A 68 LEU HB3 1.0 0.0 6.5 1643 1334 A 118 LEU HDx% A 68 LEU HB2 1.0 0.0 6.5 1644 1335 A 68 LEU HB2 A 91 LEU HDy% 1.0 0.0 6.5 1645 1335 A 91 LEU HDx% A 68 LEU HB3 1.0 0.0 6.5 1646 1335 A 68 LEU HB2 A 91 LEU HDx% 1.0 0.0 6.5 1647 1335 A 68 LEU HB3 A 91 LEU HDy% 1.0 0.0 6.5 1648 1336 A 69 PHE H A 68 LEU HD1% 1.0 0.0 6.5 1649 1337 A 69 PHE H A 68 LEU HD2% 1.0 0.0 6.5 1650 1338 A 92 MET H A 68 LEU HD2% 1.0 0.0 6.5 1651 1338 A 92 MET H A 68 LEU HD1% 1.0 0.0 6.5 1652 1339 A 69 PHE H A 69 PHE HD1 1.0 0.0 6.5 1653 1340 A 69 PHE H A 69 PHE HD2 1.0 0.0 6.5 1654 1341 A 70 ASP H A 69 PHE H 1.0 0.0 6.5 1655 1342 A 69 PHE H A 90 PHE H 1.0 0.0 6.5 1656 1343 A 69 PHE H A 90 PHE O 1.0 0.0 4.0 1657 1344 A 69 PHE H A 90 PHE HBy 1.0 0.0 6.5 1658 1344 A 69 PHE H A 90 PHE HBx 1.0 0.0 6.5 1659 1345 A 91 LEU HA A 69 PHE H 1.0 0.0 6.5 1660 1346 A 69 PHE H A 91 LEU HB2 1.0 0.0 6.5 1661 1347 A 69 PHE H A 91 LEU HB3 1.0 0.0 6.5 1662 1348 A 69 PHE H A 91 LEU HDy% 1.0 0.0 6.5 1663 1348 A 91 LEU HDx% A 69 PHE H 1.0 0.0 6.5 1664 1349 A 70 ASP H A 69 PHE HB2 1.0 0.0 6.5 1665 1350 A 69 PHE HB2 A 89 LEU HB3 1.0 0.0 6.5 1666 1351 A 69 PHE HB2 A 90 PHE H 1.0 0.0 6.5 1667 1352 A 70 ASP H A 69 PHE HB3 1.0 0.0 6.5 1668 1353 A 89 LEU HB3 A 69 PHE HB3 1.0 0.0 6.5 1669 1354 A 90 PHE H A 69 PHE HB3 1.0 0.0 6.5 1670 1355 A 69 PHE HD2 A 72 GLU H 1.0 0.0 6.5 1671 1356 A 72 GLU H A 69 PHE HE2 1.0 0.0 6.5 1672 1357 A 90 PHE O A 69 PHE N 1.0 0.0 4.5 1673 1358 A 90 PHE H A 69 PHE O 1.0 0.0 4.0 1674 1359 A 69 PHE O A 90 PHE N 1.0 0.0 4.5 1675 1360 A 70 ASP H A 71 PHE H 1.0 0.0 6.5 1676 1361 A 70 ASP H A 89 LEU HD2% 1.0 0.0 6.5 1677 1361 A 70 ASP H A 89 LEU HD1% 1.0 0.0 6.5 1678 1362 A 70 ASP HA A 71 PHE H 1.0 0.0 6.5 1679 1363 A 70 ASP HA A 88 LYS H 1.0 0.0 6.5 1680 1364 A 70 ASP HA A 89 LEU HA 1.0 0.0 5.5 1681 1365 A 70 ASP HA A 89 LEU HB2 1.0 0.0 6.5 1682 1366 A 70 ASP HA A 89 LEU HB3 1.0 0.0 6.5 1683 1367 A 70 ASP HA A 89 LEU HD1% 1.0 0.0 6.5 1684 1368 A 70 ASP HA A 89 LEU HD2% 1.0 0.0 6.5 1685 1369 A 70 ASP HA A 90 PHE H 1.0 0.0 6.5 1686 1370 A 71 PHE H A 70 ASP HB2 1.0 0.0 6.5 1687 1371 A 89 LEU HB2 A 70 ASP HB2 1.0 0.0 6.5 1688 1372 A 89 LEU HB3 A 70 ASP HB2 1.0 0.0 6.5 1689 1373 A 89 LEU HD1% A 70 ASP HB2 1.0 0.0 6.5 1690 1374 A 70 ASP HB2 A 89 LEU HD2% 1.0 0.0 6.5 1691 1375 A 90 PHE H A 70 ASP HB2 1.0 0.0 6.5 1692 1376 A 70 ASP HB3 A 71 PHE H 1.0 0.0 6.5 1693 1377 A 70 ASP HB3 A 89 LEU HB2 1.0 0.0 6.5 1694 1378 A 70 ASP HB3 A 89 LEU HB3 1.0 0.0 6.5 1695 1379 A 70 ASP HB3 A 89 LEU HD1% 1.0 0.0 6.5 1696 1380 A 70 ASP HB3 A 89 LEU HD2% 1.0 0.0 6.5 1697 1381 A 70 ASP HB3 A 90 PHE H 1.0 0.0 6.5 1698 1382 A 71 PHE H A 71 PHE HBy 1.0 0.0 6.5 1699 1383 A 71 PHE HBx A 71 PHE H 1.0 0.0 6.5 1700 1384 A 71 PHE H A 71 PHE HDx 1.0 0.0 6.5 1701 1385 A 71 PHE H A 71 PHE HDy 1.0 0.0 6.5 1702 1386 A 71 PHE H A 71 PHE HE1 1.0 0.0 6.5 1703 1387 A 71 PHE H A 71 PHE HE2 1.0 0.0 6.5 1704 1388 A 72 GLU H A 71 PHE H 1.0 0.0 6.5 1705 1389 A 71 PHE H A 87 GLN HA 1.0 0.0 6.5 1706 1390 A 71 PHE H A 87 GLN HB2 1.0 0.0 6.5 1707 1391 A 71 PHE H A 88 LYS H 1.0 0.0 6.5 1708 1392 A 71 PHE H A 88 LYS O 1.0 0.0 4.0 1709 1393 A 71 PHE H A 89 LEU H 1.0 0.0 6.5 1710 1394 A 89 LEU HA A 71 PHE H 1.0 0.0 6.5 1711 1395 A 71 PHE H A 89 LEU HB2 1.0 0.0 6.5 1712 1396 A 89 LEU HB3 A 71 PHE H 1.0 0.0 6.5 1713 1397 A 71 PHE H A 89 LEU HG 1.0 0.0 6.5 1714 1398 A 71 PHE H A 89 LEU HD2% 1.0 0.0 6.5 1715 1398 A 71 PHE H A 89 LEU HD1% 1.0 0.0 6.5 1716 1399 A 72 GLU H A 71 PHE HA 1.0 0.0 6.5 1717 1400 A 72 GLU H A 71 PHE HBy 1.0 0.0 6.5 1718 1401 A 71 PHE HBx A 72 GLU H 1.0 0.0 6.5 1719 1402 A 88 LYS H A 71 PHE HDy 1.0 0.0 6.5 1720 1403 A 88 LYS O A 71 PHE N 1.0 0.0 4.5 1721 1404 A 88 LYS H A 71 PHE O 1.0 0.0 4.5 1722 1405 A 71 PHE O A 88 LYS N 1.0 0.0 4.5 1723 1406 A 72 GLU H A 71 PHE HBy 1.0 0.0 6.5 1724 1406 A 71 PHE HBx A 72 GLU H 1.0 0.0 6.5 1725 1407 A 88 LYS H A 71 PHE HBy 1.0 0.0 6.5 1726 1407 A 71 PHE HBx A 88 LYS H 1.0 0.0 6.5 1727 1408 A 71 PHE HBy A 88 LYS HDy 1.0 0.0 6.5 1728 1408 A 71 PHE HBx A 88 LYS HDy 1.0 0.0 6.5 1729 1408 A 88 LYS HDx A 71 PHE HBy 1.0 0.0 6.5 1730 1408 A 71 PHE HBx A 88 LYS HDx 1.0 0.0 6.5 1731 1409 A 72 GLU H A 72 GLU HBy 1.0 0.0 6.5 1732 1410 A 72 GLU H A 72 GLU HBx 1.0 0.0 6.5 1733 1411 A 72 GLU H A 72 GLU HG2 1.0 0.0 6.5 1734 1412 A 72 GLU H A 72 GLU HG3 1.0 0.0 6.5 1735 1413 A 72 GLU H A 72 GLU HBx 1.0 0.0 5.5 1736 1413 A 72 GLU H A 72 GLU HBy 1.0 0.0 5.5 1737 1414 A 72 GLU H A 73 TYR H 1.0 0.0 6.5 1738 1415 A 72 GLU H A 85 LYS HG2 1.0 0.0 6.5 1739 1416 A 72 GLU H A 85 LYS HG3 1.0 0.0 6.5 1740 1417 A 73 TYR H A 72 GLU HA 1.0 0.0 5.5 1741 1418 A 72 GLU HA A 86 LYS H 1.0 0.0 6.5 1742 1419 A 88 LYS H A 72 GLU HA 1.0 0.0 5.5 1743 1420 A 73 TYR H A 72 GLU HBx 1.0 0.0 5.5 1744 1420 A 72 GLU HBy A 73 TYR H 1.0 0.0 5.5 1745 1421 A 86 LYS H A 72 GLU HBx 1.0 0.0 6.5 1746 1421 A 72 GLU HBy A 86 LYS H 1.0 0.0 6.5 1747 1422 A 88 LYS H A 72 GLU HBx 1.0 0.0 6.5 1748 1422 A 88 LYS H A 72 GLU HBy 1.0 0.0 6.5 1749 1423 A 73 TYR H A 73 TYR HD1 1.0 0.0 6.5 1750 1424 A 73 TYR H A 73 TYR HD2 1.0 0.0 6.5 1751 1425 A 73 TYR H A 74 MET H 1.0 0.0 6.5 1752 1426 A 73 TYR H A 85 LYS HA 1.0 0.0 6.5 1753 1427 A 73 TYR H A 85 LYS HG2 1.0 0.0 6.5 1754 1428 A 73 TYR H A 85 LYS HG3 1.0 0.0 6.5 1755 1429 A 73 TYR H A 86 LYS H 1.0 0.0 6.5 1756 1430 A 87 GLN HA A 73 TYR H 1.0 0.0 6.5 1757 1431 A 74 MET H A 73 TYR HA 1.0 0.0 5.5 1758 1432 A 74 MET H A 73 TYR HBy 1.0 0.0 6.5 1759 1433 A 74 MET H A 73 TYR HBx 1.0 0.0 6.5 1760 1434 A 73 TYR HD1 A 74 MET H 1.0 0.0 6.5 1761 1435 A 73 TYR HD2 A 74 MET H 1.0 0.0 6.5 1762 1436 A 73 TYR HE1 A 139 GLU H 1.0 0.0 6.5 1763 1437 A 74 MET H A 73 TYR HE2 1.0 0.0 6.5 1764 1438 A 86 LYS H A 73 TYR O 1.0 0.0 4.5 1765 1439 A 73 TYR O A 86 LYS N 1.0 0.0 4.5 1766 1440 A 73 TYR HBx A 143 ARG HB3 1.0 0.0 6.5 1767 1440 A 73 TYR HBy A 143 ARG HB3 1.0 0.0 6.5 1768 1440 A 143 ARG HB2 A 73 TYR HBy 1.0 0.0 6.5 1769 1440 A 73 TYR HBx A 143 ARG HB2 1.0 0.0 6.5 1770 1441 A 74 MET H A 74 MET HB2 1.0 0.0 6.5 1771 1442 A 74 MET H A 74 MET HB3 1.0 0.0 6.5 1772 1443 A 74 MET H A 74 MET HG2 1.0 0.0 6.5 1773 1444 A 74 MET H A 74 MET HG3 1.0 0.0 6.5 1774 1445 A 74 MET H A 75 HIS H 1.0 0.0 6.5 1775 1446 A 75 HIS H A 74 MET HA 1.0 0.0 5.0 1776 1447 A 74 MET HA A 83 SER HB2 1.0 0.0 6.5 1777 1448 A 74 MET HA A 83 SER HB3 1.0 0.0 6.5 1778 1449 A 74 MET HA A 84 SER H 1.0 0.0 6.5 1779 1450 A 85 LYS HA A 74 MET HA 1.0 0.0 6.5 1780 1451 A 74 MET HA A 85 LYS HD2 1.0 0.0 6.5 1781 1452 A 74 MET HA A 85 LYS HD3 1.0 0.0 6.5 1782 1453 A 85 LYS HG2 A 74 MET HA 1.0 0.0 6.5 1783 1454 A 85 LYS HG3 A 74 MET HA 1.0 0.0 6.5 1784 1455 A 86 LYS H A 74 MET HA 1.0 0.0 6.5 1785 1456 A 75 HIS H A 74 MET HB2 1.0 0.0 6.5 1786 1457 A 74 MET HB2 A 83 SER HB2 1.0 0.0 6.5 1787 1458 A 74 MET HB2 A 83 SER HB3 1.0 0.0 6.5 1788 1459 A 84 SER H A 74 MET HB2 1.0 0.0 6.5 1789 1460 A 85 LYS HA A 74 MET HB2 1.0 0.0 6.5 1790 1461 A 85 LYS HB2 A 74 MET HB2 1.0 0.0 6.5 1791 1462 A 85 LYS HB3 A 74 MET HB2 1.0 0.0 6.5 1792 1463 A 86 LYS H A 74 MET HB2 1.0 0.0 6.5 1793 1464 A 75 HIS H A 74 MET HB3 1.0 0.0 6.5 1794 1465 A 83 SER HB2 A 74 MET HB3 1.0 0.0 6.5 1795 1466 A 74 MET HB3 A 83 SER HB3 1.0 0.0 6.5 1796 1467 A 84 SER H A 74 MET HB3 1.0 0.0 6.5 1797 1468 A 85 LYS HA A 74 MET HB3 1.0 0.0 6.5 1798 1469 A 85 LYS HB2 A 74 MET HB3 1.0 0.0 6.5 1799 1470 A 85 LYS HB3 A 74 MET HB3 1.0 0.0 6.5 1800 1471 A 86 LYS H A 74 MET HB3 1.0 0.0 6.5 1801 1472 A 74 MET HG2 A 75 HIS H 1.0 0.0 6.5 1802 1473 A 74 MET HG3 A 75 HIS H 1.0 0.0 6.5 1803 1474 A 85 LYS H A 74 MET HB3 1.0 0.0 6.5 1804 1474 A 74 MET HB2 A 85 LYS H 1.0 0.0 6.5 1805 1475 A 75 HIS H A 75 HIS HBy 1.0 0.0 6.5 1806 1476 A 75 HIS H A 75 HIS HBx 1.0 0.0 6.5 1807 1477 A 75 HIS H A 75 HIS HD2 1.0 0.0 6.5 1808 1478 A 75 HIS H A 76 GLN H 1.0 0.0 6.5 1809 1479 A 75 HIS H A 83 SER HB2 1.0 0.0 6.5 1810 1480 A 75 HIS H A 83 SER HB3 1.0 0.0 6.5 1811 1481 A 75 HIS H A 84 SER H 1.0 0.0 6.5 1812 1482 A 75 HIS H A 84 SER HA 1.0 0.0 6.5 1813 1483 A 75 HIS H A 84 SER O 1.0 0.0 4.5 1814 1484 A 75 HIS H A 84 SER HBy 1.0 0.0 6.5 1815 1484 A 75 HIS H A 84 SER HBx 1.0 0.0 6.5 1816 1485 A 85 LYS HA A 75 HIS H 1.0 0.0 6.5 1817 1486 A 76 GLN H A 75 HIS HA 1.0 0.0 5.5 1818 1487 A 75 HIS HA A 83 SER H 1.0 0.0 6.5 1819 1488 A 75 HIS HBy A 76 GLN H 1.0 0.0 6.5 1820 1489 A 84 SER H A 75 HIS HBy 1.0 0.0 6.5 1821 1490 A 75 HIS HBx A 76 GLN H 1.0 0.0 6.5 1822 1491 A 84 SER H A 75 HIS HBx 1.0 0.0 6.5 1823 1492 A 84 SER O A 75 HIS N 1.0 0.0 4.5 1824 1493 A 84 SER H A 75 HIS O 1.0 0.0 4.5 1825 1494 A 75 HIS O A 84 SER N 1.0 0.0 4.5 1826 1495 A 76 GLN H A 76 GLN HBy 1.0 0.0 6.5 1827 1496 A 76 GLN H A 76 GLN HBx 1.0 0.0 6.5 1828 1497 A 76 GLN H A 76 GLN HGy 1.0 0.0 6.5 1829 1497 A 76 GLN H A 76 GLN HGx 1.0 0.0 6.5 1830 1498 A 76 GLN H A 77 CYS H 1.0 0.0 6.5 1831 1499 A 76 GLN H A 83 SER HA 1.0 0.0 6.5 1832 1500 A 76 GLN H A 83 SER HB2 1.0 0.0 6.5 1833 1501 A 76 GLN H A 83 SER HB3 1.0 0.0 6.5 1834 1502 A 77 CYS H A 76 GLN HA 1.0 0.0 5.5 1835 1503 A 83 SER H A 76 GLN HA 1.0 0.0 5.5 1836 1504 A 83 SER HA A 76 GLN HA 1.0 0.0 6.5 1837 1505 A 84 SER H A 76 GLN HA 1.0 0.0 6.5 1838 1506 A 77 CYS H A 76 GLN HBy 1.0 0.0 6.5 1839 1507 A 77 CYS H A 76 GLN HBx 1.0 0.0 6.5 1840 1508 A 77 CYS H A 76 GLN HBx 1.0 0.0 6.5 1841 1508 A 77 CYS H A 76 GLN HBy 1.0 0.0 6.5 1842 1509 A 83 SER H A 76 GLN HBx 1.0 0.0 6.5 1843 1509 A 83 SER H A 76 GLN HBy 1.0 0.0 6.5 1844 1510 A 84 SER H A 76 GLN HBx 1.0 0.0 6.5 1845 1510 A 84 SER H A 76 GLN HBy 1.0 0.0 6.5 1846 1511 A 77 CYS H A 76 GLN HGy 1.0 0.0 6.5 1847 1511 A 76 GLN HGx A 77 CYS H 1.0 0.0 6.5 1848 1512 A 83 SER H A 76 GLN HGy 1.0 0.0 6.5 1849 1512 A 83 SER H A 76 GLN HGx 1.0 0.0 6.5 1850 1513 A 76 GLN HGy A 83 SER HB3 1.0 0.0 6.5 1851 1513 A 76 GLN HGx A 83 SER HB3 1.0 0.0 6.5 1852 1513 A 83 SER HB2 A 76 GLN HGy 1.0 0.0 6.5 1853 1513 A 76 GLN HGx A 83 SER HB2 1.0 0.0 6.5 1854 1514 A 84 SER H A 76 GLN HGy 1.0 0.0 6.5 1855 1514 A 84 SER H A 76 GLN HGx 1.0 0.0 6.5 1856 1515 A 77 CYS H A 77 CYS HBy 1.0 0.0 5.5 1857 1515 A 77 CYS H A 77 CYS HBx 1.0 0.0 5.5 1858 1516 A 77 CYS H A 78 GLN H 1.0 0.0 6.5 1859 1517 A 77 CYS H A 78 GLN HA 1.0 0.0 6.5 1860 1518 A 78 GLN H A 77 CYS HBy 1.0 0.0 6.5 1861 1519 A 77 CYS HBx A 78 GLN H 1.0 0.0 6.5 1862 1520 A 78 GLN H A 77 CYS HBy 1.0 0.0 6.5 1863 1520 A 77 CYS HBx A 78 GLN H 1.0 0.0 6.5 1864 1521 A 78 GLN H A 78 GLN HGy 1.0 0.0 6.5 1865 1522 A 78 GLN H A 78 GLN HGx 1.0 0.0 6.5 1866 1523 A 78 GLN H A 78 GLN HGx 1.0 0.0 6.5 1867 1523 A 78 GLN H A 78 GLN HGy 1.0 0.0 6.5 1868 1524 A 78 GLN H A 79 GLY H 1.0 0.0 6.5 1869 1525 A 78 GLN H A 80 THR H 1.0 0.0 6.5 1870 1526 A 79 GLY H A 78 GLN HB2 1.0 0.0 6.5 1871 1527 A 80 THR H A 78 GLN HB2 1.0 0.0 6.5 1872 1528 A 79 GLY H A 78 GLN HB3 1.0 0.0 6.5 1873 1529 A 80 THR H A 78 GLN HB3 1.0 0.0 6.5 1874 1530 A 78 GLN HGy A 79 GLY H 1.0 0.0 6.5 1875 1531 A 79 GLY H A 78 GLN HGx 1.0 0.0 6.5 1876 1532 A 79 GLY H A 80 THR H 1.0 0.0 6.5 1877 1533 A 80 THR HB A 79 GLY HAy 1.0 0.0 6.5 1878 1534 A 80 THR HB A 79 GLY HAx 1.0 0.0 6.5 1879 1535 A 80 THR HA A 79 GLY HAy 1.0 0.0 6.5 1880 1535 A 79 GLY HAx A 80 THR HA 1.0 0.0 6.5 1881 1536 A 80 THR HB A 79 GLY HAy 1.0 0.0 6.5 1882 1536 A 80 THR HB A 79 GLY HAx 1.0 0.0 6.5 1883 1537 A 80 THR H A 80 THR HG2% 1.0 0.0 6.5 1884 1538 A 80 THR H A 81 SER H 1.0 0.0 6.5 1885 1539 A 80 THR HB A 81 SER H 1.0 0.0 6.5 1886 1540 A 80 THR HB A 82 GLU HG2 1.0 0.0 6.5 1887 1541 A 80 THR HB A 82 GLU HG3 1.0 0.0 6.5 1888 1542 A 80 THR HB A 82 GLU HBx 1.0 0.0 6.5 1889 1542 A 80 THR HB A 82 GLU HBy 1.0 0.0 6.5 1890 1543 A 80 THR HG2% A 81 SER H 1.0 0.0 6.5 1891 1544 A 80 THR HG2% A 82 GLU H 1.0 0.0 6.5 1892 1545 A 81 SER H A 81 SER HB2 1.0 0.0 6.5 1893 1546 A 81 SER H A 81 SER HB3 1.0 0.0 6.5 1894 1547 A 81 SER H A 82 GLU H 1.0 0.0 6.5 1895 1548 A 82 GLU H A 81 SER HB2 1.0 0.0 6.5 1896 1549 A 82 GLU H A 81 SER HB3 1.0 0.0 6.5 1897 1550 A 82 GLU HBy A 82 GLU H 1.0 0.0 6.5 1898 1551 A 82 GLU H A 82 GLU HBx 1.0 0.0 6.5 1899 1552 A 82 GLU HG2 A 82 GLU H 1.0 0.0 6.5 1900 1553 A 82 GLU HG3 A 82 GLU H 1.0 0.0 6.5 1901 1554 A 82 GLU H A 82 GLU HBx 1.0 0.0 5.5 1902 1554 A 82 GLU HBy A 82 GLU H 1.0 0.0 5.5 1903 1555 A 83 SER H A 82 GLU H 1.0 0.0 6.5 1904 1556 A 83 SER H A 82 GLU HA 1.0 0.0 6.5 1905 1557 A 83 SER H A 82 GLU HBy 1.0 0.0 6.5 1906 1558 A 83 SER H A 82 GLU HBx 1.0 0.0 6.5 1907 1559 A 83 SER H A 82 GLU HG2 1.0 0.0 6.5 1908 1560 A 83 SER H A 82 GLU HG3 1.0 0.0 6.5 1909 1561 A 83 SER H A 82 GLU HBx 1.0 0.0 6.5 1910 1561 A 83 SER H A 82 GLU HBy 1.0 0.0 6.5 1911 1562 A 82 GLU HBy A 84 SER HBy 1.0 0.0 6.5 1912 1562 A 82 GLU HBx A 84 SER HBy 1.0 0.0 6.5 1913 1562 A 84 SER HBx A 82 GLU HBx 1.0 0.0 6.5 1914 1562 A 84 SER HBx A 82 GLU HBy 1.0 0.0 6.5 1915 1563 A 83 SER H A 83 SER HA 1.0 0.0 5.5 1916 1564 A 83 SER H A 83 SER HB2 1.0 0.0 6.5 1917 1565 A 83 SER H A 83 SER HB3 1.0 0.0 6.5 1918 1566 A 84 SER H A 83 SER H 1.0 0.0 6.5 1919 1567 A 85 LYS HA A 83 SER HA 1.0 0.0 6.5 1920 1568 A 84 SER H A 83 SER HB2 1.0 0.0 6.5 1921 1569 A 84 SER H A 83 SER HB3 1.0 0.0 6.5 1922 1570 A 84 SER H A 84 SER HBx 1.0 0.0 5.0 1923 1571 A 84 SER H A 84 SER HBy 1.0 0.0 5.5 1924 1572 A 84 SER H A 85 LYS H 1.0 0.0 6.5 1925 1573 A 85 LYS H A 84 SER HBx 1.0 0.0 6.5 1926 1574 A 85 LYS H A 84 SER HBy 1.0 0.0 6.5 1927 1575 A 85 LYS H A 84 SER HBy 1.0 0.0 6.5 1928 1575 A 85 LYS H A 84 SER HBx 1.0 0.0 6.5 1929 1576 A 85 LYS HB2 A 85 LYS H 1.0 0.0 6.5 1930 1577 A 85 LYS HB3 A 85 LYS H 1.0 0.0 6.5 1931 1578 A 85 LYS HD2 A 85 LYS H 1.0 0.0 6.5 1932 1579 A 85 LYS HD3 A 85 LYS H 1.0 0.0 6.5 1933 1580 A 85 LYS H A 85 LYS HE2 1.0 0.0 6.5 1934 1581 A 85 LYS H A 85 LYS HE3 1.0 0.0 6.5 1935 1582 A 85 LYS HG2 A 85 LYS H 1.0 0.0 6.5 1936 1583 A 85 LYS HG3 A 85 LYS H 1.0 0.0 6.5 1937 1584 A 86 LYS H A 85 LYS H 1.0 0.0 6.5 1938 1585 A 86 LYS H A 85 LYS HB2 1.0 0.0 6.5 1939 1586 A 86 LYS H A 85 LYS HB3 1.0 0.0 6.5 1940 1587 A 86 LYS H A 85 LYS HD2 1.0 0.0 6.5 1941 1588 A 86 LYS H A 85 LYS HD3 1.0 0.0 6.5 1942 1589 A 85 LYS HG2 A 86 LYS H 1.0 0.0 6.5 1943 1590 A 85 LYS HG3 A 86 LYS H 1.0 0.0 6.5 1944 1591 A 86 LYS H A 86 LYS HE2 1.0 0.0 6.5 1945 1592 A 86 LYS H A 86 LYS HE3 1.0 0.0 6.5 1946 1593 A 86 LYS H A 86 LYS HG2 1.0 0.0 6.5 1947 1594 A 86 LYS H A 86 LYS HG3 1.0 0.0 6.5 1948 1595 A 86 LYS H A 86 LYS HDx 1.0 0.0 6.5 1949 1595 A 86 LYS H A 86 LYS HDy 1.0 0.0 6.5 1950 1596 A 86 LYS H A 87 GLN H 1.0 0.0 6.5 1951 1597 A 87 GLN H A 86 LYS HA 1.0 0.0 5.5 1952 1598 A 86 LYS HA A 88 LYS HG2 1.0 0.0 6.5 1953 1599 A 86 LYS HA A 88 LYS HG3 1.0 0.0 6.5 1954 1600 A 86 LYS HA A 88 LYS HDy 1.0 0.0 6.5 1955 1600 A 88 LYS HDx A 86 LYS HA 1.0 0.0 6.5 1956 1601 A 87 GLN H A 86 LYS HB2 1.0 0.0 6.5 1957 1602 A 87 GLN H A 86 LYS HB3 1.0 0.0 6.5 1958 1603 A 86 LYS HDy A 87 GLN H 1.0 0.0 6.5 1959 1604 A 87 GLN H A 86 LYS HDx 1.0 0.0 6.5 1960 1605 A 86 LYS HG2 A 87 GLN H 1.0 0.0 6.5 1961 1606 A 86 LYS HG3 A 87 GLN H 1.0 0.0 6.5 1962 1607 A 87 GLN H A 86 LYS HDx 1.0 0.0 6.5 1963 1607 A 86 LYS HDy A 87 GLN H 1.0 0.0 6.5 1964 1608 A 86 LYS HDy A 88 LYS HG3 1.0 0.0 5.5 1965 1608 A 86 LYS HDx A 88 LYS HG3 1.0 0.0 5.5 1966 1608 A 88 LYS HG2 A 86 LYS HDx 1.0 0.0 5.5 1967 1608 A 86 LYS HDy A 88 LYS HG2 1.0 0.0 5.5 1968 1609 A 87 GLN HB2 A 87 GLN H 1.0 0.0 6.5 1969 1610 A 87 GLN H A 87 GLN HB3 1.0 0.0 6.5 1970 1611 A 87 GLN H A 87 GLN HG2 1.0 0.0 6.5 1971 1612 A 87 GLN H A 87 GLN HG3 1.0 0.0 6.5 1972 1613 A 88 LYS H A 87 GLN H 1.0 0.0 6.5 1973 1614 A 87 GLN H A 88 LYS HG2 1.0 0.0 6.5 1974 1615 A 87 GLN H A 88 LYS HG3 1.0 0.0 6.5 1975 1616 A 88 LYS H A 87 GLN HB2 1.0 0.0 6.5 1976 1617 A 88 LYS H A 87 GLN HB3 1.0 0.0 6.5 1977 1618 A 88 LYS H A 87 GLN HG2 1.0 0.0 6.5 1978 1619 A 88 LYS H A 87 GLN HG3 1.0 0.0 6.5 1979 1620 A 88 LYS H A 88 LYS HG2 1.0 0.0 6.5 1980 1621 A 88 LYS H A 88 LYS HG3 1.0 0.0 6.5 1981 1622 A 88 LYS H A 88 LYS HDy 1.0 0.0 5.5 1982 1622 A 88 LYS H A 88 LYS HDx 1.0 0.0 5.5 1983 1623 A 88 LYS H A 89 LEU H 1.0 0.0 6.5 1984 1624 A 89 LEU H A 88 LYS HA 1.0 0.0 5.5 1985 1625 A 89 LEU H A 88 LYS HB2 1.0 0.0 6.5 1986 1626 A 89 LEU H A 88 LYS HB3 1.0 0.0 6.5 1987 1627 A 89 LEU H A 88 LYS HG2 1.0 0.0 6.5 1988 1628 A 89 LEU H A 88 LYS HG3 1.0 0.0 6.5 1989 1629 A 89 LEU H A 121 VAL HG1% 1.0 0.0 6.5 1990 1630 A 89 LEU H A 121 VAL HG2% 1.0 0.0 6.5 1991 1631 A 89 LEU HB2 A 89 LEU H 1.0 0.0 6.5 1992 1632 A 89 LEU HB3 A 89 LEU H 1.0 0.0 6.5 1993 1633 A 89 LEU H A 89 LEU HG 1.0 0.0 6.5 1994 1634 A 89 LEU HD1% A 89 LEU H 1.0 0.0 6.5 1995 1635 A 89 LEU H A 89 LEU HD2% 1.0 0.0 6.5 1996 1636 A 90 PHE H A 89 LEU H 1.0 0.0 6.5 1997 1637 A 89 LEU HA A 90 PHE H 1.0 0.0 5.5 1998 1638 A 89 LEU HB2 A 121 VAL HA 1.0 0.0 5.5 1999 1639 A 89 LEU HB2 A 121 VAL HG1% 1.0 0.0 6.5 2000 1640 A 89 LEU HB2 A 121 VAL HG2% 1.0 0.0 6.5 2001 1641 A 89 LEU HB2 A 123 LYS H 1.0 0.0 6.5 2002 1642 A 90 PHE H A 89 LEU HB2 1.0 0.0 6.5 2003 1643 A 89 LEU HB3 A 121 VAL HA 1.0 0.0 5.5 2004 1644 A 89 LEU HB3 A 121 VAL HG1% 1.0 0.0 6.5 2005 1645 A 89 LEU HB3 A 121 VAL HG2% 1.0 0.0 6.5 2006 1646 A 89 LEU HB3 A 123 LYS H 1.0 0.0 6.5 2007 1647 A 90 PHE H A 89 LEU HB3 1.0 0.0 6.5 2008 1648 A 90 PHE H A 89 LEU HG 1.0 0.0 6.5 2009 1649 A 123 LYS H A 89 LEU O 1.0 0.0 4.5 2010 1650 A 89 LEU O A 123 LYS N 1.0 0.0 4.5 2011 1651 A 89 LEU HD1% A 122 GLN HBy 1.0 0.0 6.5 2012 1652 A 89 LEU HD1% A 122 GLN HBx 1.0 0.0 6.5 2013 1653 A 89 LEU HD1% A 122 GLN HG2 1.0 0.0 6.5 2014 1654 A 89 LEU HD1% A 122 GLN HG3 1.0 0.0 6.5 2015 1655 A 90 PHE H A 89 LEU HD1% 1.0 0.0 6.5 2016 1656 A 122 GLN HBy A 89 LEU HD2% 1.0 0.0 6.5 2017 1657 A 122 GLN HG2 A 89 LEU HD2% 1.0 0.0 6.5 2018 1658 A 122 GLN HG3 A 89 LEU HD2% 1.0 0.0 6.5 2019 1659 A 90 PHE H A 89 LEU HD2% 1.0 0.0 6.5 2020 1660 A 89 LEU HD1% A 122 GLN HBx 1.0 0.0 6.5 2021 1660 A 122 GLN HBy A 89 LEU HD2% 1.0 0.0 6.5 2022 1660 A 89 LEU HD1% A 122 GLN HBy 1.0 0.0 6.5 2023 1660 A 89 LEU HD2% A 122 GLN HBx 1.0 0.0 6.5 2024 1661 A 90 PHE H A 90 PHE HD1 1.0 0.0 6.5 2025 1662 A 90 PHE H A 90 PHE HD2 1.0 0.0 6.5 2026 1663 A 90 PHE H A 90 PHE HE1 1.0 0.0 6.5 2027 1664 A 90 PHE H A 91 LEU H 1.0 0.0 6.5 2028 1665 A 90 PHE HA A 121 VAL HG1% 1.0 0.0 6.5 2029 1666 A 90 PHE HA A 121 VAL HG2% 1.0 0.0 6.5 2030 1667 A 123 LYS H A 90 PHE HA 1.0 0.0 6.5 2031 1668 A 90 PHE HA A 123 LYS HA 1.0 0.0 6.5 2032 1669 A 90 PHE HA A 123 LYS HB2 1.0 0.0 6.5 2033 1670 A 90 PHE HA A 123 LYS HB3 1.0 0.0 6.5 2034 1671 A 90 PHE HA A 123 LYS HDx 1.0 0.0 6.5 2035 1672 A 90 PHE HA A 123 LYS HDy 1.0 0.0 6.5 2036 1673 A 90 PHE HA A 123 LYS HG2 1.0 0.0 6.5 2037 1674 A 90 PHE HA A 123 LYS HG3 1.0 0.0 6.5 2038 1675 A 90 PHE HA A 142 LEU HA 1.0 0.0 6.5 2039 1676 A 91 LEU H A 90 PHE HA 1.0 0.0 5.5 2040 1677 A 121 VAL HG1% A 90 PHE HBy 1.0 0.0 6.5 2041 1678 A 90 PHE HBy A 121 VAL HG2% 1.0 0.0 6.5 2042 1679 A 123 LYS H A 90 PHE HBy 1.0 0.0 6.5 2043 1680 A 91 LEU H A 90 PHE HBy 1.0 0.0 6.5 2044 1681 A 90 PHE HBx A 121 VAL HG1% 1.0 0.0 6.5 2045 1682 A 90 PHE HBx A 121 VAL HG2% 1.0 0.0 6.5 2046 1683 A 90 PHE HBx A 123 LYS H 1.0 0.0 6.5 2047 1684 A 90 PHE HBx A 91 LEU H 1.0 0.0 6.5 2048 1685 A 90 PHE HBy A 121 VAL HG2% 1.0 0.0 6.5 2049 1685 A 121 VAL HG1% A 90 PHE HBy 1.0 0.0 6.5 2050 1685 A 90 PHE HBx A 121 VAL HG1% 1.0 0.0 6.5 2051 1685 A 90 PHE HBx A 121 VAL HG2% 1.0 0.0 6.5 2052 1686 A 123 LYS H A 90 PHE HBy 1.0 0.0 6.5 2053 1686 A 90 PHE HBx A 123 LYS H 1.0 0.0 6.5 2054 1687 A 90 PHE HBx A 123 LYS HDy 1.0 0.0 5.5 2055 1687 A 90 PHE HBy A 123 LYS HDy 1.0 0.0 5.5 2056 1687 A 123 LYS HDx A 90 PHE HBy 1.0 0.0 5.5 2057 1687 A 90 PHE HBx A 123 LYS HDx 1.0 0.0 5.5 2058 1688 A 90 PHE HBx A 123 LYS HG3 1.0 0.0 5.5 2059 1688 A 90 PHE HBy A 123 LYS HG3 1.0 0.0 5.5 2060 1688 A 123 LYS HG2 A 90 PHE HBy 1.0 0.0 5.5 2061 1688 A 90 PHE HBx A 123 LYS HG2 1.0 0.0 5.5 2062 1689 A 90 PHE HBy A 142 LEU HDy% 1.0 0.0 6.5 2063 1689 A 142 LEU HDx% A 90 PHE HBy 1.0 0.0 6.5 2064 1689 A 90 PHE HBx A 142 LEU HDx% 1.0 0.0 6.5 2065 1689 A 90 PHE HBx A 142 LEU HDy% 1.0 0.0 6.5 2066 1690 A 91 LEU H A 90 PHE HBy 1.0 0.0 6.5 2067 1690 A 90 PHE HBx A 91 LEU H 1.0 0.0 6.5 2068 1691 A 123 LYS H A 91 LEU H 1.0 0.0 6.5 2069 1692 A 91 LEU H A 123 LYS HB2 1.0 0.0 6.5 2070 1693 A 91 LEU H A 123 LYS HB3 1.0 0.0 5.5 2071 1694 A 91 LEU H A 123 LYS HG2 1.0 0.0 5.5 2072 1695 A 91 LEU H A 123 LYS HG3 1.0 0.0 6.5 2073 1696 A 91 LEU H A 123 LYS O 1.0 0.0 4.0 2074 1697 A 91 LEU H A 124 TYR HA 1.0 0.0 6.5 2075 1698 A 91 LEU H A 124 TYR HBy 1.0 0.0 6.5 2076 1699 A 91 LEU H A 124 TYR HBx 1.0 0.0 6.5 2077 1700 A 91 LEU H A 125 ILE H 1.0 0.0 6.5 2078 1701 A 91 LEU H A 91 LEU HG 1.0 0.0 6.5 2079 1702 A 91 LEU HDx% A 91 LEU H 1.0 0.0 6.5 2080 1703 A 91 LEU H A 91 LEU HDy% 1.0 0.0 6.5 2081 1704 A 91 LEU H A 91 LEU HDy% 1.0 0.0 6.5 2082 1704 A 91 LEU HDx% A 91 LEU H 1.0 0.0 6.5 2083 1705 A 92 MET H A 91 LEU H 1.0 0.0 6.5 2084 1706 A 91 LEU HA A 92 MET H 1.0 0.0 5.5 2085 1707 A 124 TYR HA A 91 LEU HB2 1.0 0.0 6.5 2086 1708 A 125 ILE H A 91 LEU HB2 1.0 0.0 6.5 2087 1709 A 92 MET H A 91 LEU HB2 1.0 0.0 6.5 2088 1710 A 124 TYR HA A 91 LEU HB3 1.0 0.0 6.5 2089 1711 A 125 ILE H A 91 LEU HB3 1.0 0.0 6.5 2090 1712 A 92 MET H A 91 LEU HB3 1.0 0.0 6.5 2091 1713 A 92 MET H A 91 LEU HG 1.0 0.0 6.5 2092 1714 A 123 LYS O A 91 LEU N 1.0 0.0 4.5 2093 1715 A 125 ILE H A 91 LEU O 1.0 0.0 4.0 2094 1716 A 91 LEU O A 125 ILE N 1.0 0.0 4.5 2095 1717 A 91 LEU HB2 A 124 TYR HBy 1.0 0.0 6.5 2096 1717 A 91 LEU HB3 A 124 TYR HBy 1.0 0.0 6.5 2097 1717 A 124 TYR HBx A 91 LEU HB3 1.0 0.0 6.5 2098 1717 A 91 LEU HB2 A 124 TYR HBx 1.0 0.0 6.5 2099 1718 A 114 LEU H A 91 LEU HDx% 1.0 0.0 6.5 2100 1719 A 91 LEU HDx% A 115 LYS H 1.0 0.0 6.5 2101 1720 A 91 LEU HDx% A 92 MET H 1.0 0.0 6.5 2102 1721 A 114 LEU H A 91 LEU HDy% 1.0 0.0 6.5 2103 1722 A 115 LYS H A 91 LEU HDy% 1.0 0.0 6.5 2104 1723 A 92 MET H A 91 LEU HDy% 1.0 0.0 6.5 2105 1724 A 114 LEU H A 91 LEU HDy% 1.0 0.0 6.5 2106 1724 A 114 LEU H A 91 LEU HDx% 1.0 0.0 6.5 2107 1725 A 115 LYS H A 91 LEU HDy% 1.0 0.0 6.5 2108 1725 A 91 LEU HDx% A 115 LYS H 1.0 0.0 6.5 2109 1726 A 92 MET H A 91 LEU HDy% 1.0 0.0 6.5 2110 1726 A 91 LEU HDx% A 92 MET H 1.0 0.0 6.5 2111 1727 A 92 MET H A 92 MET HG2 1.0 0.0 6.5 2112 1728 A 92 MET H A 92 MET HG3 1.0 0.0 6.5 2113 1729 A 92 MET H A 93 SER H 1.0 0.0 6.5 2114 1730 A 125 ILE H A 92 MET HA 1.0 0.0 6.5 2115 1731 A 92 MET HA A 125 ILE HB 1.0 0.0 6.5 2116 1732 A 92 MET HA A 125 ILE HD1% 1.0 0.0 6.5 2117 1733 A 92 MET HA A 125 ILE HG13 1.0 0.0 6.5 2118 1733 A 92 MET HA A 125 ILE HG12 1.0 0.0 6.5 2119 1734 A 92 MET HA A 125 ILE HG2% 1.0 0.0 6.5 2120 1735 A 93 SER H A 92 MET HA 1.0 0.0 6.5 2121 1736 A 125 ILE H A 92 MET HB2 1.0 0.0 6.5 2122 1737 A 125 ILE HB A 92 MET HB2 1.0 0.0 6.5 2123 1738 A 125 ILE HD1% A 92 MET HB2 1.0 0.0 6.5 2124 1739 A 125 ILE HG2% A 92 MET HB2 1.0 0.0 6.5 2125 1740 A 93 SER H A 92 MET HB2 1.0 0.0 6.5 2126 1741 A 125 ILE H A 92 MET HB3 1.0 0.0 6.5 2127 1742 A 125 ILE HB A 92 MET HB3 1.0 0.0 6.5 2128 1743 A 125 ILE HD1% A 92 MET HB3 1.0 0.0 6.5 2129 1744 A 125 ILE HG2% A 92 MET HB3 1.0 0.0 6.5 2130 1745 A 93 SER H A 92 MET HB3 1.0 0.0 6.5 2131 1746 A 92 MET HG2 A 125 ILE H 1.0 0.0 6.5 2132 1747 A 92 MET HG2 A 125 ILE HG2% 1.0 0.0 6.5 2133 1748 A 92 MET HG2 A 127 ALA HB% 1.0 0.0 6.5 2134 1749 A 92 MET HG2 A 93 SER H 1.0 0.0 6.5 2135 1750 A 92 MET HG3 A 125 ILE H 1.0 0.0 6.5 2136 1751 A 92 MET HG3 A 125 ILE HG2% 1.0 0.0 6.5 2137 1752 A 92 MET HG3 A 127 ALA HB% 1.0 0.0 6.5 2138 1753 A 92 MET HG3 A 93 SER H 1.0 0.0 6.5 2139 1754 A 92 MET HB2 A 125 ILE HG13 1.0 0.0 6.5 2140 1754 A 125 ILE HG12 A 92 MET HB3 1.0 0.0 6.5 2141 1754 A 125 ILE HG12 A 92 MET HB2 1.0 0.0 6.5 2142 1754 A 92 MET HB3 A 125 ILE HG13 1.0 0.0 6.5 2143 1755 A 125 ILE H A 93 SER H 1.0 0.0 6.5 2144 1756 A 93 SER H A 125 ILE HA 1.0 0.0 6.5 2145 1757 A 93 SER H A 125 ILE HB 1.0 0.0 6.5 2146 1758 A 93 SER H A 125 ILE O 1.0 0.0 4.0 2147 1759 A 93 SER H A 125 ILE HG13 1.0 0.0 6.5 2148 1759 A 93 SER H A 125 ILE HG12 1.0 0.0 6.5 2149 1760 A 93 SER H A 125 ILE HG2% 1.0 0.0 6.5 2150 1761 A 93 SER H A 126 GLN HA 1.0 0.0 6.5 2151 1762 A 93 SER H A 126 GLN HB2 1.0 0.0 6.5 2152 1763 A 93 SER H A 126 GLN HB3 1.0 0.0 6.5 2153 1764 A 93 SER H A 126 GLN HG2 1.0 0.0 6.5 2154 1765 A 93 SER H A 126 GLN HG3 1.0 0.0 6.5 2155 1766 A 93 SER H A 127 ALA H 1.0 0.0 6.5 2156 1767 A 93 SER HBy A 93 SER H 1.0 0.0 6.5 2157 1768 A 93 SER H A 93 SER HBx 1.0 0.0 6.5 2158 1769 A 94 TRP H A 93 SER H 1.0 0.0 6.5 2159 1770 A 93 SER HA A 126 GLN HB2 1.0 0.0 6.5 2160 1771 A 93 SER HA A 126 GLN HB3 1.0 0.0 6.5 2161 1772 A 93 SER HA A 127 ALA H 1.0 0.0 6.5 2162 1773 A 94 TRP H A 93 SER HA 1.0 0.0 5.5 2163 1774 A 93 SER HBy A 111 PHE HA 1.0 0.0 6.5 2164 1775 A 93 SER HBy A 126 GLN HB2 1.0 0.0 6.5 2165 1776 A 93 SER HBy A 126 GLN HB3 1.0 0.0 6.5 2166 1777 A 93 SER HBy A 126 GLN HG2 1.0 0.0 6.5 2167 1778 A 93 SER HBy A 126 GLN HG3 1.0 0.0 6.5 2168 1779 A 93 SER HBy A 127 ALA H 1.0 0.0 6.5 2169 1780 A 94 TRP H A 93 SER HBy 1.0 0.0 6.5 2170 1781 A 111 PHE HA A 93 SER HBx 1.0 0.0 6.5 2171 1782 A 126 GLN HB2 A 93 SER HBx 1.0 0.0 6.5 2172 1783 A 93 SER HBx A 126 GLN HB3 1.0 0.0 6.5 2173 1784 A 126 GLN HG2 A 93 SER HBx 1.0 0.0 6.5 2174 1785 A 126 GLN HG3 A 93 SER HBx 1.0 0.0 6.5 2175 1786 A 127 ALA H A 93 SER HBx 1.0 0.0 6.5 2176 1787 A 94 TRP H A 93 SER HBx 1.0 0.0 6.5 2177 1788 A 125 ILE O A 93 SER N 1.0 0.0 4.5 2178 1789 A 127 ALA H A 93 SER O 1.0 0.0 4.0 2179 1790 A 93 SER O A 127 ALA N 1.0 0.0 4.5 2180 1791 A 111 PHE HA A 93 SER HBx 1.0 0.0 6.5 2181 1791 A 93 SER HBy A 111 PHE HA 1.0 0.0 6.5 2182 1792 A 93 SER HBy A 111 PHE HBy 1.0 0.0 6.5 2183 1792 A 93 SER HBx A 111 PHE HBy 1.0 0.0 6.5 2184 1792 A 111 PHE HBx A 93 SER HBx 1.0 0.0 6.5 2185 1792 A 93 SER HBy A 111 PHE HBx 1.0 0.0 6.5 2186 1793 A 93 SER HBy A 125 ILE HG13 1.0 0.0 6.5 2187 1793 A 93 SER HBx A 125 ILE HG13 1.0 0.0 6.5 2188 1793 A 125 ILE HG12 A 93 SER HBx 1.0 0.0 6.5 2189 1793 A 93 SER HBy A 125 ILE HG12 1.0 0.0 6.5 2190 1794 A 93 SER HBy A 126 GLN HB3 1.0 0.0 5.5 2191 1794 A 126 GLN HB2 A 93 SER HBx 1.0 0.0 5.5 2192 1794 A 93 SER HBy A 126 GLN HB2 1.0 0.0 5.5 2193 1794 A 93 SER HBx A 126 GLN HB3 1.0 0.0 5.5 2194 1795 A 94 TRP H A 93 SER HBx 1.0 0.0 6.5 2195 1795 A 94 TRP H A 93 SER HBy 1.0 0.0 6.5 2196 1796 A 94 TRP H A 126 GLN HG2 1.0 0.0 6.5 2197 1797 A 94 TRP H A 126 GLN HG3 1.0 0.0 6.5 2198 1798 A 94 TRP H A 95 CYS H 1.0 0.0 6.5 2199 1799 A 94 TRP H A 95 CYS HBy 1.0 0.0 6.5 2200 1799 A 95 CYS HBx A 94 TRP H 1.0 0.0 6.5 2201 1800 A 94 TRP HA A 126 GLN HA 1.0 0.0 6.5 2202 1801 A 94 TRP HA A 127 ALA H 1.0 0.0 6.5 2203 1802 A 94 TRP HA A 127 ALA HB% 1.0 0.0 6.5 2204 1803 A 95 CYS H A 94 TRP HA 1.0 0.0 5.5 2205 1804 A 94 TRP HB2 A 127 ALA H 1.0 0.0 6.5 2206 1805 A 95 CYS H A 94 TRP HB2 1.0 0.0 6.5 2207 1806 A 94 TRP HB3 A 127 ALA H 1.0 0.0 6.5 2208 1807 A 95 CYS H A 94 TRP HB3 1.0 0.0 6.5 2209 1808 A 95 CYS H A 127 ALA H 1.0 0.0 6.5 2210 1809 A 95 CYS H A 127 ALA HB% 1.0 0.0 6.5 2211 1810 A 95 CYS H A 128 THR HA 1.0 0.0 6.5 2212 1811 A 95 CYS H A 128 THR HB 1.0 0.0 6.5 2213 1812 A 95 CYS H A 128 THR HG2% 1.0 0.0 6.5 2214 1813 A 95 CYS H A 95 CYS HBy 1.0 0.0 6.5 2215 1814 A 95 CYS HBx A 95 CYS H 1.0 0.0 6.5 2216 1815 A 95 CYS H A 95 CYS HBy 1.0 0.0 5.5 2217 1815 A 95 CYS HBx A 95 CYS H 1.0 0.0 5.5 2218 1816 A 127 ALA H A 95 CYS HBy 1.0 0.0 6.5 2219 1816 A 95 CYS HBx A 127 ALA H 1.0 0.0 6.5 2220 1817 A 128 THR HA A 96 PRO HA 1.0 0.0 5.5 2221 1818 A 128 THR HB A 96 PRO HA 1.0 0.0 5.5 2222 1819 A 96 PRO HA A 97 ASP H 1.0 0.0 5.5 2223 1820 A 96 PRO HA A 98 THR H 1.0 0.0 6.5 2224 1821 A 96 PRO HA A 99 ALA H 1.0 0.0 6.5 2225 1822 A 128 THR HA A 96 PRO HB2 1.0 0.0 6.5 2226 1823 A 128 THR HB A 96 PRO HB2 1.0 0.0 6.5 2227 1824 A 129 ASP HA A 96 PRO HB2 1.0 0.0 6.5 2228 1825 A 98 THR H A 96 PRO HB2 1.0 0.0 6.5 2229 1826 A 99 ALA H A 96 PRO HB2 1.0 0.0 6.5 2230 1827 A 99 ALA HB% A 96 PRO HB2 1.0 0.0 6.5 2231 1828 A 128 THR HA A 96 PRO HB3 1.0 0.0 6.5 2232 1829 A 128 THR HB A 96 PRO HB3 1.0 0.0 6.5 2233 1830 A 129 ASP HA A 96 PRO HB3 1.0 0.0 6.5 2234 1831 A 98 THR H A 96 PRO HB3 1.0 0.0 6.5 2235 1832 A 99 ALA H A 96 PRO HB3 1.0 0.0 6.5 2236 1833 A 99 ALA HB% A 96 PRO HB3 1.0 0.0 6.5 2237 1834 A 128 THR HB A 96 PRO HG2 1.0 0.0 6.5 2238 1835 A 97 ASP H A 96 PRO HG2 1.0 0.0 6.5 2239 1836 A 98 THR H A 96 PRO HG2 1.0 0.0 6.5 2240 1837 A 128 THR HB A 96 PRO HG3 1.0 0.0 6.5 2241 1838 A 97 ASP H A 96 PRO HG3 1.0 0.0 6.5 2242 1839 A 98 THR H A 96 PRO HG3 1.0 0.0 6.5 2243 1840 A 96 PRO HB2 A 129 ASP HBy 1.0 0.0 5.5 2244 1840 A 96 PRO HB3 A 129 ASP HBy 1.0 0.0 5.5 2245 1840 A 129 ASP HBx A 96 PRO HB3 1.0 0.0 5.5 2246 1840 A 96 PRO HB2 A 129 ASP HBx 1.0 0.0 5.5 2247 1841 A 96 PRO HG3 A 129 ASP HBy 1.0 0.0 6.5 2248 1841 A 96 PRO HG2 A 129 ASP HBy 1.0 0.0 6.5 2249 1841 A 129 ASP HBx A 96 PRO HG3 1.0 0.0 6.5 2250 1841 A 129 ASP HBx A 96 PRO HG2 1.0 0.0 6.5 2251 1842 A 128 THR HA A 97 ASP H 1.0 0.0 6.5 2252 1843 A 128 THR HB A 97 ASP H 1.0 0.0 6.5 2253 1844 A 128 THR HG2% A 97 ASP H 1.0 0.0 6.5 2254 1845 A 97 ASP H A 129 ASP HBy 1.0 0.0 6.5 2255 1845 A 97 ASP H A 129 ASP HBx 1.0 0.0 6.5 2256 1846 A 97 ASP H A 97 ASP HB2 1.0 0.0 5.5 2257 1847 A 97 ASP H A 97 ASP HB3 1.0 0.0 5.5 2258 1848 A 97 ASP H A 98 THR H 1.0 0.0 6.5 2259 1849 A 98 THR H A 97 ASP HA 1.0 0.0 6.5 2260 1850 A 99 ALA H A 97 ASP HA 1.0 0.0 6.5 2261 1851 A 98 THR H A 97 ASP HB2 1.0 0.0 6.5 2262 1852 A 99 ALA H A 97 ASP HB2 1.0 0.0 6.5 2263 1853 A 99 ALA HB% A 97 ASP HB2 1.0 0.0 6.5 2264 1854 A 98 THR H A 97 ASP HB3 1.0 0.0 6.5 2265 1855 A 99 ALA H A 97 ASP HB3 1.0 0.0 6.5 2266 1856 A 99 ALA HB% A 97 ASP HB3 1.0 0.0 6.5 2267 1857 A 128 THR HA A 97 ASP HB2 1.0 0.0 6.5 2268 1857 A 128 THR HA A 97 ASP HB3 1.0 0.0 6.5 2269 1858 A 128 THR HB A 97 ASP HB2 1.0 0.0 6.5 2270 1858 A 128 THR HB A 97 ASP HB3 1.0 0.0 6.5 2271 1859 A 128 THR HG2% A 97 ASP HB2 1.0 0.0 6.5 2272 1859 A 128 THR HG2% A 97 ASP HB3 1.0 0.0 6.5 2273 1860 A 98 THR HA A 97 ASP HB2 1.0 0.0 6.5 2274 1860 A 97 ASP HB3 A 98 THR HA 1.0 0.0 6.5 2275 1861 A 98 THR H A 98 THR HB 1.0 0.0 6.5 2276 1862 A 98 THR H A 98 THR HG2% 1.0 0.0 6.5 2277 1863 A 98 THR H A 99 ALA H 1.0 0.0 5.5 2278 1864 A 99 ALA HB% A 98 THR H 1.0 0.0 6.5 2279 1865 A 99 ALA H A 98 THR HA 1.0 0.0 5.5 2280 1866 A 99 ALA H A 98 THR HB 1.0 0.0 6.5 2281 1867 A 99 ALA H A 98 THR HG2% 1.0 0.0 6.5 2282 1868 A 99 ALA H A 100 LYS H 1.0 0.0 6.5 2283 1869 A 99 ALA H A 104 LYS HG2 1.0 0.0 6.5 2284 1870 A 99 ALA H A 104 LYS HG3 1.0 0.0 6.5 2285 1871 A 99 ALA HB% A 99 ALA H 1.0 0.0 6.5 2286 1872 A 99 ALA HB% A 100 LYS H 1.0 0.0 6.5 2287 1873 A 100 LYS H A 100 LYS HD2 1.0 0.0 6.5 2288 1874 A 100 LYS H A 100 LYS HD3 1.0 0.0 6.5 2289 1875 A 100 LYS H A 100 LYS HE2 1.0 0.0 6.5 2290 1876 A 100 LYS H A 100 LYS HE3 1.0 0.0 6.5 2291 1877 A 100 LYS H A 100 LYS HGy 1.0 0.0 6.5 2292 1878 A 100 LYS H A 100 LYS HGx 1.0 0.0 6.5 2293 1879 A 100 LYS H A 100 LYS HGx 1.0 0.0 6.5 2294 1879 A 100 LYS H A 100 LYS HGy 1.0 0.0 6.5 2295 1880 A 100 LYS H A 101 VAL H 1.0 0.0 6.5 2296 1881 A 101 VAL H A 100 LYS HA 1.0 0.0 5.5 2297 1882 A 100 LYS HA A 103 LYS HB2 1.0 0.0 6.5 2298 1883 A 100 LYS HA A 103 LYS HB3 1.0 0.0 6.5 2299 1884 A 101 VAL H A 100 LYS HB2 1.0 0.0 6.5 2300 1885 A 101 VAL H A 100 LYS HB3 1.0 0.0 6.5 2301 1886 A 100 LYS HD2 A 101 VAL H 1.0 0.0 6.5 2302 1887 A 100 LYS HD3 A 101 VAL H 1.0 0.0 6.5 2303 1888 A 100 LYS HGy A 101 VAL H 1.0 0.0 6.5 2304 1889 A 100 LYS HGy A 104 LYS H 1.0 0.0 6.5 2305 1890 A 101 VAL H A 100 LYS HGx 1.0 0.0 6.5 2306 1891 A 104 LYS H A 100 LYS HGx 1.0 0.0 6.5 2307 1892 A 101 VAL H A 100 LYS HGx 1.0 0.0 6.5 2308 1892 A 100 LYS HGy A 101 VAL H 1.0 0.0 6.5 2309 1893 A 102 LYS H A 100 LYS HGx 1.0 0.0 5.5 2310 1893 A 100 LYS HGy A 102 LYS H 1.0 0.0 5.5 2311 1894 A 103 LYS H A 100 LYS HGx 1.0 0.0 6.5 2312 1894 A 100 LYS HGy A 103 LYS H 1.0 0.0 6.5 2313 1895 A 104 LYS H A 100 LYS HGx 1.0 0.0 6.5 2314 1895 A 100 LYS HGy A 104 LYS H 1.0 0.0 6.5 2315 1896 A 105 MET H A 100 LYS HGx 1.0 0.0 6.5 2316 1896 A 100 LYS HGy A 105 MET H 1.0 0.0 6.5 2317 1897 A 101 VAL H A 101 VAL HB 1.0 0.0 6.5 2318 1898 A 101 VAL H A 101 VAL HGx% 1.0 0.0 6.5 2319 1899 A 101 VAL H A 101 VAL HGy% 1.0 0.0 6.5 2320 1900 A 101 VAL H A 101 VAL HGy% 1.0 0.0 6.5 2321 1900 A 101 VAL H A 101 VAL HGx% 1.0 0.0 6.5 2322 1901 A 101 VAL H A 102 LYS H 1.0 0.0 6.5 2323 1902 A 101 VAL H A 103 LYS H 1.0 0.0 6.5 2324 1903 A 102 LYS H A 101 VAL HA 1.0 0.0 6.5 2325 1904 A 103 LYS H A 101 VAL HA 1.0 0.0 6.5 2326 1905 A 104 LYS H A 101 VAL HA 1.0 0.0 6.5 2327 1906 A 105 MET H A 101 VAL HA 1.0 0.0 6.5 2328 1907 A 102 LYS H A 101 VAL HB 1.0 0.0 6.5 2329 1908 A 101 VAL HB A 104 LYS HG2 1.0 0.0 6.5 2330 1909 A 101 VAL HB A 104 LYS HG3 1.0 0.0 6.5 2331 1910 A 101 VAL HGx% A 104 LYS HG3 1.0 0.0 6.5 2332 1910 A 104 LYS HG2 A 101 VAL HGy% 1.0 0.0 6.5 2333 1910 A 101 VAL HGx% A 104 LYS HG2 1.0 0.0 6.5 2334 1910 A 101 VAL HGy% A 104 LYS HG3 1.0 0.0 6.5 2335 1911 A 105 MET H A 101 VAL HGy% 1.0 0.0 6.5 2336 1911 A 105 MET H A 101 VAL HGx% 1.0 0.0 6.5 2337 1912 A 102 LYS H A 102 LYS HB2 1.0 0.0 5.5 2338 1913 A 102 LYS H A 102 LYS HB3 1.0 0.0 6.5 2339 1914 A 102 LYS H A 102 LYS HD2 1.0 0.0 5.5 2340 1915 A 102 LYS H A 102 LYS HD3 1.0 0.0 5.5 2341 1916 A 102 LYS H A 102 LYS HE2 1.0 0.0 6.5 2342 1917 A 102 LYS H A 102 LYS HE3 1.0 0.0 6.5 2343 1918 A 102 LYS H A 102 LYS HG2 1.0 0.0 6.5 2344 1919 A 102 LYS H A 102 LYS HG3 1.0 0.0 6.5 2345 1920 A 102 LYS H A 103 LYS H 1.0 0.0 5.5 2346 1921 A 104 LYS H A 102 LYS H 1.0 0.0 6.5 2347 1922 A 104 LYS H A 102 LYS HA 1.0 0.0 6.5 2348 1923 A 105 MET H A 102 LYS HA 1.0 0.0 6.5 2349 1924 A 102 LYS HA A 105 MET HA 1.0 0.0 6.5 2350 1925 A 102 LYS HA A 105 MET HB2 1.0 0.0 5.5 2351 1926 A 102 LYS HA A 105 MET HB3 1.0 0.0 6.5 2352 1927 A 105 MET HG2 A 102 LYS HA 1.0 0.0 6.5 2353 1928 A 102 LYS HA A 105 MET HG3 1.0 0.0 6.5 2354 1929 A 106 LEU H A 102 LYS HA 1.0 0.0 6.5 2355 1930 A 103 LYS H A 102 LYS HB2 1.0 0.0 6.5 2356 1931 A 102 LYS HB2 A 105 MET HB2 1.0 0.0 6.5 2357 1932 A 102 LYS HB2 A 105 MET HB3 1.0 0.0 6.5 2358 1933 A 103 LYS H A 102 LYS HB3 1.0 0.0 6.5 2359 1934 A 102 LYS HB3 A 105 MET HB2 1.0 0.0 6.5 2360 1935 A 102 LYS HB3 A 105 MET HB3 1.0 0.0 6.5 2361 1936 A 103 LYS H A 102 LYS HG2 1.0 0.0 6.5 2362 1937 A 103 LYS H A 102 LYS HG3 1.0 0.0 6.5 2363 1938 A 103 LYS H A 103 LYS HB2 1.0 0.0 6.5 2364 1939 A 103 LYS H A 103 LYS HB3 1.0 0.0 6.5 2365 1940 A 103 LYS H A 103 LYS HD2 1.0 0.0 6.5 2366 1941 A 103 LYS H A 103 LYS HD3 1.0 0.0 6.5 2367 1942 A 103 LYS H A 103 LYS HE2 1.0 0.0 6.5 2368 1943 A 103 LYS H A 103 LYS HE3 1.0 0.0 6.5 2369 1944 A 103 LYS H A 103 LYS HG2 1.0 0.0 6.5 2370 1945 A 103 LYS H A 103 LYS HG3 1.0 0.0 6.5 2371 1946 A 104 LYS H A 103 LYS H 1.0 0.0 6.5 2372 1947 A 103 LYS H A 105 MET H 1.0 0.0 6.5 2373 1948 A 105 MET H A 103 LYS HA 1.0 0.0 6.5 2374 1949 A 106 LEU H A 103 LYS HA 1.0 0.0 5.5 2375 1950 A 106 LEU HA A 103 LYS HA 1.0 0.0 6.5 2376 1951 A 103 LYS HA A 106 LEU HBx 1.0 0.0 6.5 2377 1952 A 103 LYS HA A 106 LEU HBy 1.0 0.0 6.5 2378 1953 A 103 LYS HA A 106 LEU HG 1.0 0.0 5.5 2379 1954 A 106 LEU HDx% A 103 LYS HA 1.0 0.0 6.5 2380 1955 A 103 LYS HA A 106 LEU HDy% 1.0 0.0 6.5 2381 1956 A 107 TYR H A 103 LYS HA 1.0 0.0 6.5 2382 1957 A 104 LYS H A 103 LYS HB2 1.0 0.0 6.5 2383 1958 A 106 LEU HG A 103 LYS HB2 1.0 0.0 6.5 2384 1959 A 106 LEU HDx% A 103 LYS HB2 1.0 0.0 6.5 2385 1960 A 103 LYS HB2 A 106 LEU HDy% 1.0 0.0 6.5 2386 1961 A 104 LYS H A 103 LYS HB3 1.0 0.0 6.5 2387 1962 A 106 LEU HG A 103 LYS HB3 1.0 0.0 6.5 2388 1963 A 106 LEU HDx% A 103 LYS HB3 1.0 0.0 6.5 2389 1964 A 103 LYS HB3 A 106 LEU HDy% 1.0 0.0 6.5 2390 1965 A 103 LYS HE2 A 106 LEU HG 1.0 0.0 6.5 2391 1966 A 103 LYS HE3 A 106 LEU HG 1.0 0.0 6.5 2392 1967 A 104 LYS H A 103 LYS HG2 1.0 0.0 6.5 2393 1968 A 103 LYS HG2 A 106 LEU HG 1.0 0.0 6.5 2394 1969 A 104 LYS H A 103 LYS HG3 1.0 0.0 6.5 2395 1970 A 103 LYS HG3 A 106 LEU HG 1.0 0.0 5.5 2396 1971 A 103 LYS HB2 A 106 LEU HDy% 1.0 0.0 6.5 2397 1971 A 103 LYS HB3 A 106 LEU HDy% 1.0 0.0 6.5 2398 1971 A 106 LEU HDx% A 103 LYS HB3 1.0 0.0 6.5 2399 1971 A 106 LEU HDx% A 103 LYS HB2 1.0 0.0 6.5 2400 1972 A 104 LYS H A 104 LYS HDy 1.0 0.0 6.5 2401 1973 A 104 LYS H A 104 LYS HDx 1.0 0.0 6.5 2402 1974 A 104 LYS H A 104 LYS HE2 1.0 0.0 6.5 2403 1975 A 104 LYS H A 104 LYS HE3 1.0 0.0 6.5 2404 1976 A 104 LYS H A 104 LYS HG2 1.0 0.0 6.5 2405 1977 A 104 LYS H A 104 LYS HG3 1.0 0.0 6.5 2406 1978 A 104 LYS H A 104 LYS HDx 1.0 0.0 6.5 2407 1978 A 104 LYS H A 104 LYS HDy 1.0 0.0 6.5 2408 1979 A 104 LYS H A 105 MET H 1.0 0.0 6.5 2409 1980 A 106 LEU H A 104 LYS H 1.0 0.0 6.5 2410 1981 A 106 LEU H A 104 LYS HA 1.0 0.0 6.5 2411 1982 A 107 TYR H A 104 LYS HA 1.0 0.0 6.5 2412 1983 A 108 SER H A 104 LYS HA 1.0 0.0 6.5 2413 1984 A 105 MET H A 104 LYS HDy 1.0 0.0 6.5 2414 1985 A 105 MET H A 104 LYS HDx 1.0 0.0 6.5 2415 1986 A 105 MET H A 104 LYS HG2 1.0 0.0 6.5 2416 1987 A 105 MET H A 104 LYS HG3 1.0 0.0 6.5 2417 1988 A 104 LYS HB2 A 107 TYR HBy 1.0 0.0 6.5 2418 1988 A 104 LYS HB3 A 107 TYR HBy 1.0 0.0 6.5 2419 1988 A 107 TYR HBx A 104 LYS HB2 1.0 0.0 6.5 2420 1988 A 107 TYR HBx A 104 LYS HB3 1.0 0.0 6.5 2421 1989 A 105 MET H A 104 LYS HDx 1.0 0.0 5.5 2422 1989 A 105 MET H A 104 LYS HDy 1.0 0.0 5.5 2423 1990 A 105 MET H A 105 MET HB2 1.0 0.0 6.5 2424 1991 A 105 MET H A 105 MET HB3 1.0 0.0 6.5 2425 1992 A 105 MET HG2 A 105 MET H 1.0 0.0 6.5 2426 1993 A 105 MET H A 105 MET HG3 1.0 0.0 6.5 2427 1994 A 106 LEU H A 105 MET H 1.0 0.0 6.5 2428 1995 A 107 TYR H A 105 MET H 1.0 0.0 6.5 2429 1996 A 106 LEU H A 105 MET HA 1.0 0.0 6.5 2430 1997 A 107 TYR H A 105 MET HA 1.0 0.0 6.5 2431 1998 A 108 SER H A 105 MET HA 1.0 0.0 6.5 2432 1999 A 105 MET HA A 109 SER H 1.0 0.0 6.5 2433 2000 A 106 LEU H A 105 MET HB2 1.0 0.0 6.5 2434 2001 A 108 SER H A 105 MET HB2 1.0 0.0 6.5 2435 2002 A 106 LEU H A 105 MET HB3 1.0 0.0 6.5 2436 2003 A 108 SER H A 105 MET HB3 1.0 0.0 6.5 2437 2004 A 105 MET HG2 A 106 LEU H 1.0 0.0 6.5 2438 2005 A 106 LEU H A 105 MET HG3 1.0 0.0 6.5 2439 2006 A 109 SER H A 105 MET HB3 1.0 0.0 6.5 2440 2006 A 109 SER H A 105 MET HB2 1.0 0.0 6.5 2441 2007 A 106 LEU H A 106 LEU HBx 1.0 0.0 6.5 2442 2008 A 106 LEU H A 106 LEU HBy 1.0 0.0 6.5 2443 2009 A 106 LEU H A 106 LEU HG 1.0 0.0 6.5 2444 2010 A 106 LEU H A 106 LEU HBy 1.0 0.0 5.5 2445 2010 A 106 LEU H A 106 LEU HBx 1.0 0.0 5.5 2446 2011 A 106 LEU HDx% A 106 LEU H 1.0 0.0 6.5 2447 2012 A 106 LEU H A 106 LEU HDy% 1.0 0.0 6.5 2448 2013 A 107 TYR H A 106 LEU H 1.0 0.0 6.5 2449 2014 A 106 LEU H A 108 SER H 1.0 0.0 6.5 2450 2015 A 106 LEU HA A 107 TYR H 1.0 0.0 6.5 2451 2016 A 106 LEU HA A 108 SER H 1.0 0.0 6.5 2452 2017 A 106 LEU HA A 109 SER H 1.0 0.0 6.5 2453 2018 A 110 SER H A 106 LEU HA 1.0 0.0 6.5 2454 2019 A 107 TYR H A 106 LEU HBx 1.0 0.0 6.5 2455 2020 A 108 SER H A 106 LEU HBx 1.0 0.0 6.5 2456 2021 A 110 SER H A 106 LEU HBx 1.0 0.0 6.5 2457 2022 A 107 TYR H A 106 LEU HBy 1.0 0.0 6.5 2458 2023 A 108 SER H A 106 LEU HBy 1.0 0.0 6.5 2459 2024 A 107 TYR H A 106 LEU HG 1.0 0.0 6.5 2460 2025 A 108 SER H A 106 LEU HBy 1.0 0.0 6.5 2461 2025 A 108 SER H A 106 LEU HBx 1.0 0.0 6.5 2462 2026 A 110 SER H A 106 LEU HBy 1.0 0.0 6.5 2463 2026 A 110 SER H A 106 LEU HBx 1.0 0.0 6.5 2464 2027 A 106 LEU HDx% A 107 TYR H 1.0 0.0 6.5 2465 2028 A 106 LEU HDx% A 108 SER H 1.0 0.0 6.5 2466 2029 A 107 TYR H A 106 LEU HDy% 1.0 0.0 6.5 2467 2030 A 108 SER H A 106 LEU HDy% 1.0 0.0 6.5 2468 2031 A 107 TYR H A 106 LEU HDy% 1.0 0.0 6.5 2469 2031 A 106 LEU HDx% A 107 TYR H 1.0 0.0 6.5 2470 2032 A 108 SER H A 106 LEU HDy% 1.0 0.0 6.5 2471 2032 A 106 LEU HDx% A 108 SER H 1.0 0.0 6.5 2472 2033 A 107 TYR HA A 107 TYR H 1.0 0.0 5.0 2473 2034 A 107 TYR H A 107 TYR HBy 1.0 0.0 6.5 2474 2035 A 107 TYR HBx A 107 TYR H 1.0 0.0 6.5 2475 2036 A 107 TYR H A 107 TYR HD1 1.0 0.0 6.5 2476 2037 A 107 TYR H A 107 TYR HD2 1.0 0.0 6.5 2477 2038 A 107 TYR H A 108 SER H 1.0 0.0 6.5 2478 2039 A 107 TYR H A 109 SER H 1.0 0.0 6.5 2479 2040 A 107 TYR HA A 108 SER H 1.0 0.0 5.5 2480 2041 A 107 TYR HA A 109 SER H 1.0 0.0 6.5 2481 2042 A 110 SER H A 107 TYR HA 1.0 0.0 6.5 2482 2043 A 107 TYR HA A 111 PHE H 1.0 0.0 6.5 2483 2044 A 108 SER H A 107 TYR HBy 1.0 0.0 6.5 2484 2045 A 107 TYR HBx A 108 SER H 1.0 0.0 6.5 2485 2046 A 109 SER H A 107 TYR HBy 1.0 0.0 6.5 2486 2046 A 107 TYR HBx A 109 SER H 1.0 0.0 6.5 2487 2047 A 108 SER H A 108 SER HB2 1.0 0.0 6.5 2488 2048 A 108 SER H A 108 SER HB3 1.0 0.0 6.5 2489 2049 A 108 SER H A 109 SER H 1.0 0.0 6.5 2490 2050 A 110 SER H A 108 SER H 1.0 0.0 6.5 2491 2051 A 108 SER H A 111 PHE H 1.0 0.0 6.5 2492 2052 A 110 SER H A 108 SER HA 1.0 0.0 6.5 2493 2053 A 111 PHE H A 108 SER HA 1.0 0.0 6.5 2494 2054 A 109 SER H A 108 SER HB2 1.0 0.0 6.5 2495 2055 A 109 SER H A 108 SER HB3 1.0 0.0 6.5 2496 2056 A 109 SER HBx A 109 SER H 1.0 0.0 6.5 2497 2057 A 109 SER H A 109 SER HBy 1.0 0.0 6.5 2498 2058 A 110 SER H A 109 SER H 1.0 0.0 6.5 2499 2059 A 109 SER H A 111 PHE H 1.0 0.0 6.5 2500 2060 A 110 SER H A 109 SER HBy 1.0 0.0 6.5 2501 2060 A 109 SER HBx A 110 SER H 1.0 0.0 6.5 2502 2061 A 111 PHE H A 109 SER HBy 1.0 0.0 6.5 2503 2061 A 109 SER HBx A 111 PHE H 1.0 0.0 6.5 2504 2062 A 112 ASP H A 109 SER HBy 1.0 0.0 6.5 2505 2062 A 109 SER HBx A 112 ASP H 1.0 0.0 6.5 2506 2063 A 110 SER HBy A 110 SER H 1.0 0.0 6.5 2507 2064 A 110 SER H A 110 SER HBx 1.0 0.0 6.5 2508 2065 A 110 SER H A 111 PHE H 1.0 0.0 5.5 2509 2066 A 110 SER H A 111 PHE HBy 1.0 0.0 6.5 2510 2067 A 110 SER H A 111 PHE HBx 1.0 0.0 6.5 2511 2068 A 110 SER H A 112 ASP H 1.0 0.0 6.5 2512 2069 A 110 SER HA A 112 ASP H 1.0 0.0 6.5 2513 2070 A 113 ALA H A 110 SER HA 1.0 0.0 6.5 2514 2071 A 110 SER HA A 113 ALA HB% 1.0 0.0 6.5 2515 2072 A 110 SER HA A 114 LEU H 1.0 0.0 6.5 2516 2073 A 110 SER HBy A 111 PHE H 1.0 0.0 6.5 2517 2074 A 110 SER HBy A 113 ALA HB% 1.0 0.0 6.5 2518 2075 A 111 PHE H A 110 SER HBx 1.0 0.0 6.5 2519 2076 A 113 ALA HB% A 110 SER HBx 1.0 0.0 6.5 2520 2077 A 113 ALA HB% A 110 SER HBx 1.0 0.0 6.5 2521 2077 A 110 SER HBy A 113 ALA HB% 1.0 0.0 6.5 2522 2078 A 111 PHE H A 111 PHE HBy 1.0 0.0 5.5 2523 2079 A 111 PHE HBx A 111 PHE H 1.0 0.0 5.5 2524 2080 A 111 PHE H A 111 PHE HD1 1.0 0.0 6.5 2525 2081 A 111 PHE H A 111 PHE HD2 1.0 0.0 6.5 2526 2082 A 111 PHE H A 112 ASP H 1.0 0.0 5.5 2527 2083 A 111 PHE H A 112 ASP HBy 1.0 0.0 6.5 2528 2084 A 111 PHE H A 112 ASP HBx 1.0 0.0 6.5 2529 2085 A 111 PHE H A 112 ASP HBy 1.0 0.0 6.5 2530 2085 A 111 PHE H A 112 ASP HBx 1.0 0.0 6.5 2531 2086 A 113 ALA H A 111 PHE H 1.0 0.0 6.5 2532 2087 A 111 PHE H A 114 LEU HDy% 1.0 0.0 6.5 2533 2087 A 114 LEU HDx% A 111 PHE H 1.0 0.0 6.5 2534 2088 A 113 ALA H A 111 PHE HA 1.0 0.0 6.5 2535 2089 A 114 LEU H A 111 PHE HA 1.0 0.0 6.5 2536 2090 A 115 LYS H A 111 PHE HA 1.0 0.0 6.5 2537 2091 A 112 ASP H A 111 PHE HBy 1.0 0.0 6.5 2538 2092 A 111 PHE HBx A 112 ASP H 1.0 0.0 6.5 2539 2093 A 111 PHE HD2 A 126 GLN H 1.0 0.0 6.5 2540 2094 A 127 ALA H A 111 PHE HD2 1.0 0.0 6.5 2541 2095 A 126 GLN H A 111 PHE HE2 1.0 0.0 6.5 2542 2096 A 127 ALA H A 111 PHE HE2 1.0 0.0 6.5 2543 2097 A 112 ASP H A 111 PHE HBy 1.0 0.0 5.5 2544 2097 A 111 PHE HBx A 112 ASP H 1.0 0.0 5.5 2545 2098 A 112 ASP H A 112 ASP HA 1.0 0.0 5.5 2546 2099 A 112 ASP H A 112 ASP HBy 1.0 0.0 5.5 2547 2100 A 112 ASP H A 112 ASP HBx 1.0 0.0 5.5 2548 2101 A 112 ASP H A 112 ASP HBy 1.0 0.0 5.0 2549 2101 A 112 ASP H A 112 ASP HBx 1.0 0.0 5.0 2550 2102 A 113 ALA H A 112 ASP H 1.0 0.0 5.5 2551 2103 A 114 LEU H A 112 ASP H 1.0 0.0 6.5 2552 2104 A 112 ASP H A 115 LYS HD2 1.0 0.0 6.5 2553 2105 A 112 ASP H A 115 LYS HD3 1.0 0.0 6.5 2554 2106 A 112 ASP H A 115 LYS HG2 1.0 0.0 6.5 2555 2107 A 112 ASP H A 115 LYS HG3 1.0 0.0 6.5 2556 2108 A 114 LEU H A 112 ASP HA 1.0 0.0 6.5 2557 2109 A 115 LYS H A 112 ASP HA 1.0 0.0 6.5 2558 2110 A 112 ASP HA A 115 LYS HA 1.0 0.0 6.5 2559 2111 A 112 ASP HA A 115 LYS HB2 1.0 0.0 6.5 2560 2112 A 112 ASP HA A 115 LYS HB3 1.0 0.0 6.5 2561 2113 A 112 ASP HA A 115 LYS HG3 1.0 0.0 5.5 2562 2113 A 112 ASP HA A 115 LYS HG2 1.0 0.0 5.5 2563 2114 A 112 ASP HA A 116 LYS H 1.0 0.0 6.5 2564 2115 A 113 ALA H A 112 ASP HBy 1.0 0.0 6.5 2565 2116 A 113 ALA H A 112 ASP HBx 1.0 0.0 6.5 2566 2117 A 113 ALA H A 113 ALA HB% 1.0 0.0 6.5 2567 2118 A 113 ALA H A 114 LEU H 1.0 0.0 6.5 2568 2119 A 113 ALA H A 114 LEU HDy% 1.0 0.0 6.5 2569 2119 A 113 ALA H A 114 LEU HDx% 1.0 0.0 6.5 2570 2120 A 113 ALA H A 115 LYS H 1.0 0.0 6.5 2571 2121 A 113 ALA H A 116 LYS H 1.0 0.0 6.5 2572 2122 A 115 LYS H A 113 ALA HA 1.0 0.0 6.5 2573 2123 A 116 LYS H A 113 ALA HA 1.0 0.0 6.5 2574 2124 A 113 ALA HA A 116 LYS HB2 1.0 0.0 6.5 2575 2125 A 113 ALA HA A 116 LYS HB3 1.0 0.0 5.5 2576 2126 A 113 ALA HA A 116 LYS HE2 1.0 0.0 5.5 2577 2127 A 113 ALA HA A 116 LYS HE3 1.0 0.0 5.5 2578 2128 A 117 SER H A 113 ALA HA 1.0 0.0 6.5 2579 2129 A 113 ALA HB% A 114 LEU H 1.0 0.0 6.5 2580 2130 A 113 ALA HB% A 116 LYS HB2 1.0 0.0 6.5 2581 2131 A 113 ALA HB% A 116 LYS HB3 1.0 0.0 6.5 2582 2132 A 113 ALA HB% A 116 LYS HE2 1.0 0.0 5.5 2583 2133 A 113 ALA HB% A 116 LYS HE3 1.0 0.0 5.5 2584 2134 A 114 LEU H A 114 LEU HG 1.0 0.0 6.5 2585 2135 A 114 LEU H A 114 LEU HDy% 1.0 0.0 6.5 2586 2135 A 114 LEU H A 114 LEU HDx% 1.0 0.0 6.5 2587 2136 A 114 LEU H A 115 LYS H 1.0 0.0 6.5 2588 2137 A 114 LEU H A 116 LYS H 1.0 0.0 6.5 2589 2138 A 114 LEU H A 117 SER H 1.0 0.0 6.5 2590 2139 A 114 LEU HA A 115 LYS H 1.0 0.0 5.5 2591 2140 A 114 LEU HA A 116 LYS H 1.0 0.0 6.5 2592 2141 A 114 LEU HA A 117 SER H 1.0 0.0 6.5 2593 2142 A 114 LEU HA A 118 LEU H 1.0 0.0 6.5 2594 2143 A 114 LEU HB2 A 115 LYS H 1.0 0.0 6.5 2595 2144 A 115 LYS H A 114 LEU HB3 1.0 0.0 6.5 2596 2145 A 115 LYS H A 114 LEU HG 1.0 0.0 6.5 2597 2146 A 114 LEU HG A 118 LEU HDy% 1.0 0.0 6.5 2598 2146 A 118 LEU HDx% A 114 LEU HG 1.0 0.0 6.5 2599 2147 A 114 LEU HDy% A 118 LEU HDy% 1.0 0.0 6.5 2600 2147 A 114 LEU HDx% A 118 LEU HDy% 1.0 0.0 6.5 2601 2147 A 118 LEU HDx% A 114 LEU HDy% 1.0 0.0 6.5 2602 2147 A 114 LEU HDx% A 118 LEU HDx% 1.0 0.0 6.5 2603 2148 A 115 LYS H A 115 LYS HD2 1.0 0.0 6.5 2604 2149 A 115 LYS H A 115 LYS HD3 1.0 0.0 6.5 2605 2150 A 115 LYS H A 115 LYS HE2 1.0 0.0 6.5 2606 2151 A 115 LYS H A 115 LYS HE3 1.0 0.0 6.5 2607 2152 A 115 LYS H A 115 LYS HG2 1.0 0.0 6.5 2608 2153 A 115 LYS H A 115 LYS HG3 1.0 0.0 6.5 2609 2154 A 115 LYS H A 116 LYS H 1.0 0.0 6.5 2610 2155 A 117 SER H A 115 LYS H 1.0 0.0 6.5 2611 2156 A 117 SER H A 115 LYS HA 1.0 0.0 6.5 2612 2157 A 118 LEU H A 115 LYS HA 1.0 0.0 6.5 2613 2158 A 115 LYS HA A 118 LEU HG 1.0 0.0 6.5 2614 2159 A 118 LEU HDx% A 115 LYS HA 1.0 0.0 6.5 2615 2160 A 115 LYS HA A 118 LEU HDy% 1.0 0.0 6.5 2616 2161 A 115 LYS HA A 121 VAL HG2% 1.0 0.0 6.5 2617 2161 A 121 VAL HG1% A 115 LYS HA 1.0 0.0 6.5 2618 2162 A 115 LYS HD2 A 116 LYS H 1.0 0.0 6.5 2619 2163 A 115 LYS HD3 A 116 LYS H 1.0 0.0 6.5 2620 2164 A 115 LYS HE2 A 124 TYR HBy 1.0 0.0 5.5 2621 2165 A 124 TYR HBx A 115 LYS HE2 1.0 0.0 5.5 2622 2166 A 115 LYS HE3 A 124 TYR HBy 1.0 0.0 5.5 2623 2167 A 124 TYR HBx A 115 LYS HE3 1.0 0.0 6.5 2624 2168 A 115 LYS HG2 A 116 LYS H 1.0 0.0 6.5 2625 2169 A 116 LYS H A 115 LYS HG3 1.0 0.0 6.5 2626 2170 A 115 LYS HE2 A 124 TYR HBy 1.0 0.0 5.0 2627 2170 A 124 TYR HBx A 115 LYS HE3 1.0 0.0 5.0 2628 2170 A 124 TYR HBx A 115 LYS HE2 1.0 0.0 5.0 2629 2170 A 115 LYS HE3 A 124 TYR HBy 1.0 0.0 5.0 2630 2171 A 116 LYS H A 116 LYS HB2 1.0 0.0 5.5 2631 2172 A 116 LYS H A 116 LYS HB3 1.0 0.0 5.5 2632 2173 A 116 LYS H A 116 LYS HD2 1.0 0.0 6.5 2633 2174 A 116 LYS H A 116 LYS HD3 1.0 0.0 6.5 2634 2175 A 116 LYS H A 116 LYS HE2 1.0 0.0 6.5 2635 2176 A 116 LYS H A 116 LYS HE3 1.0 0.0 6.5 2636 2177 A 116 LYS H A 116 LYS HG2 1.0 0.0 6.5 2637 2178 A 116 LYS H A 116 LYS HG3 1.0 0.0 6.5 2638 2179 A 118 LEU H A 116 LYS H 1.0 0.0 6.5 2639 2180 A 118 LEU H A 116 LYS HA 1.0 0.0 6.5 2640 2181 A 117 SER H A 116 LYS HB2 1.0 0.0 6.5 2641 2182 A 117 SER H A 116 LYS HB3 1.0 0.0 6.5 2642 2183 A 117 SER H A 116 LYS HD2 1.0 0.0 6.5 2643 2184 A 117 SER H A 116 LYS HD3 1.0 0.0 6.5 2644 2185 A 117 SER H A 116 LYS HG2 1.0 0.0 6.5 2645 2186 A 117 SER H A 116 LYS HG3 1.0 0.0 6.5 2646 2187 A 117 SER H A 117 SER HB2 1.0 0.0 6.5 2647 2188 A 117 SER H A 117 SER HB3 1.0 0.0 6.5 2648 2189 A 117 SER H A 118 LEU H 1.0 0.0 5.5 2649 2190 A 117 SER H A 118 LEU HB2 1.0 0.0 6.5 2650 2191 A 117 SER H A 118 LEU HB3 1.0 0.0 6.5 2651 2192 A 117 SER H A 118 LEU HG 1.0 0.0 6.5 2652 2193 A 117 SER H A 119 VAL H 1.0 0.0 6.5 2653 2194 A 118 LEU H A 117 SER HA 1.0 0.0 6.5 2654 2195 A 118 LEU H A 117 SER HB2 1.0 0.0 6.5 2655 2196 A 118 LEU H A 117 SER HB3 1.0 0.0 6.5 2656 2197 A 118 LEU HB2 A 118 LEU H 1.0 0.0 5.5 2657 2198 A 118 LEU H A 118 LEU HB3 1.0 0.0 5.5 2658 2199 A 118 LEU H A 118 LEU HG 1.0 0.0 5.5 2659 2200 A 118 LEU HDx% A 118 LEU H 1.0 0.0 6.5 2660 2201 A 118 LEU H A 118 LEU HDy% 1.0 0.0 6.5 2661 2202 A 118 LEU H A 118 LEU HDy% 1.0 0.0 6.5 2662 2202 A 118 LEU HDx% A 118 LEU H 1.0 0.0 6.5 2663 2203 A 118 LEU H A 119 VAL H 1.0 0.0 6.5 2664 2204 A 119 VAL H A 118 LEU HA 1.0 0.0 6.5 2665 2205 A 118 LEU HA A 121 VAL HG2% 1.0 0.0 6.5 2666 2206 A 118 LEU HB2 A 119 VAL H 1.0 0.0 6.5 2667 2207 A 119 VAL H A 118 LEU HB3 1.0 0.0 6.5 2668 2208 A 119 VAL H A 118 LEU HG 1.0 0.0 5.5 2669 2209 A 118 LEU HDx% A 119 VAL H 1.0 0.0 6.5 2670 2210 A 119 VAL H A 118 LEU HDy% 1.0 0.0 6.5 2671 2211 A 119 VAL H A 118 LEU HDy% 1.0 0.0 6.5 2672 2211 A 118 LEU HDx% A 119 VAL H 1.0 0.0 6.5 2673 2212 A 119 VAL H A 119 VAL HB 1.0 0.0 5.5 2674 2213 A 119 VAL H A 120 GLY H 1.0 0.0 6.5 2675 2214 A 119 VAL HB A 120 GLY H 1.0 0.0 6.5 2676 2215 A 119 VAL HGx% A 120 GLY H 1.0 0.0 6.5 2677 2216 A 119 VAL HGx% A 120 GLY HAy 1.0 0.0 6.5 2678 2217 A 119 VAL HGx% A 120 GLY HAx 1.0 0.0 6.5 2679 2218 A 120 GLY H A 119 VAL HGy% 1.0 0.0 6.5 2680 2219 A 119 VAL HGy% A 120 GLY HAy 1.0 0.0 6.5 2681 2220 A 120 GLY HAx A 119 VAL HGy% 1.0 0.0 6.5 2682 2221 A 119 VAL HGx% A 120 GLY HAy 1.0 0.0 5.5 2683 2221 A 119 VAL HGy% A 120 GLY HAy 1.0 0.0 5.5 2684 2221 A 120 GLY HAx A 119 VAL HGy% 1.0 0.0 5.5 2685 2221 A 119 VAL HGx% A 120 GLY HAx 1.0 0.0 5.5 2686 2222 A 121 VAL H A 120 GLY H 1.0 0.0 6.5 2687 2223 A 121 VAL H A 121 VAL HB 1.0 0.0 5.5 2688 2224 A 121 VAL H A 121 VAL HG1% 1.0 0.0 6.5 2689 2225 A 121 VAL H A 121 VAL HG2% 1.0 0.0 6.5 2690 2226 A 121 VAL H A 122 GLN H 1.0 0.0 6.5 2691 2227 A 121 VAL HA A 122 GLN H 1.0 0.0 6.5 2692 2228 A 121 VAL HA A 122 GLN HG2 1.0 0.0 6.5 2693 2229 A 121 VAL HA A 122 GLN HG3 1.0 0.0 6.5 2694 2230 A 121 VAL HA A 123 LYS H 1.0 0.0 6.5 2695 2231 A 121 VAL HB A 122 GLN H 1.0 0.0 6.5 2696 2232 A 121 VAL HG1% A 122 GLN H 1.0 0.0 6.5 2697 2233 A 122 GLN H A 121 VAL HG2% 1.0 0.0 6.5 2698 2234 A 123 LYS H A 121 VAL HG2% 1.0 0.0 6.5 2699 2234 A 123 LYS H A 121 VAL HG1% 1.0 0.0 6.5 2700 2235 A 122 GLN HG2 A 122 GLN H 1.0 0.0 6.5 2701 2236 A 122 GLN HG3 A 122 GLN H 1.0 0.0 6.5 2702 2237 A 123 LYS H A 122 GLN H 1.0 0.0 6.5 2703 2238 A 123 LYS H A 122 GLN HBy 1.0 0.0 6.5 2704 2239 A 123 LYS H A 122 GLN HBx 1.0 0.0 6.5 2705 2240 A 123 LYS H A 122 GLN HG2 1.0 0.0 6.5 2706 2241 A 123 LYS H A 122 GLN HG3 1.0 0.0 6.5 2707 2242 A 123 LYS H A 122 GLN HBx 1.0 0.0 5.5 2708 2242 A 123 LYS H A 122 GLN HBy 1.0 0.0 5.5 2709 2243 A 145 THR HG2% A 122 GLN HBx 1.0 0.0 6.5 2710 2243 A 122 GLN HBy A 145 THR HG2% 1.0 0.0 6.5 2711 2244 A 123 LYS H A 123 LYS HB2 1.0 0.0 6.5 2712 2245 A 123 LYS H A 123 LYS HB3 1.0 0.0 6.5 2713 2246 A 123 LYS H A 123 LYS HDx 1.0 0.0 6.5 2714 2247 A 123 LYS H A 123 LYS HDy 1.0 0.0 6.5 2715 2248 A 123 LYS H A 123 LYS HE2 1.0 0.0 6.5 2716 2249 A 123 LYS H A 123 LYS HE3 1.0 0.0 6.5 2717 2250 A 123 LYS H A 123 LYS HG2 1.0 0.0 6.5 2718 2251 A 123 LYS H A 123 LYS HG3 1.0 0.0 6.5 2719 2252 A 123 LYS H A 124 TYR H 1.0 0.0 6.5 2720 2253 A 123 LYS HA A 124 TYR H 1.0 0.0 5.5 2721 2254 A 123 LYS HA A 125 ILE HG2% 1.0 0.0 6.5 2722 2255 A 123 LYS HB2 A 124 TYR H 1.0 0.0 6.5 2723 2256 A 123 LYS HB3 A 124 TYR H 1.0 0.0 6.5 2724 2257 A 123 LYS HDx A 124 TYR H 1.0 0.0 6.5 2725 2258 A 123 LYS HDx A 141 LYS H 1.0 0.0 6.5 2726 2259 A 123 LYS HDx A 141 LYS HD2 1.0 0.0 5.5 2727 2260 A 123 LYS HDx A 141 LYS HD3 1.0 0.0 5.5 2728 2261 A 123 LYS HDx A 145 THR HB 1.0 0.0 6.5 2729 2262 A 124 TYR H A 123 LYS HDy 1.0 0.0 6.5 2730 2263 A 141 LYS H A 123 LYS HDy 1.0 0.0 6.5 2731 2264 A 141 LYS HD2 A 123 LYS HDy 1.0 0.0 5.5 2732 2265 A 141 LYS HD3 A 123 LYS HDy 1.0 0.0 5.5 2733 2266 A 145 THR HB A 123 LYS HDy 1.0 0.0 6.5 2734 2267 A 142 LEU HA A 123 LYS HE2 1.0 0.0 6.5 2735 2268 A 142 LEU HA A 123 LYS HE3 1.0 0.0 6.5 2736 2269 A 123 LYS HG2 A 124 TYR H 1.0 0.0 6.5 2737 2270 A 124 TYR H A 123 LYS HG3 1.0 0.0 5.0 2738 2271 A 124 TYR H A 124 TYR HBy 1.0 0.0 6.5 2739 2272 A 124 TYR HBx A 124 TYR H 1.0 0.0 6.5 2740 2273 A 124 TYR H A 124 TYR HD1 1.0 0.0 6.5 2741 2274 A 124 TYR H A 124 TYR HD2 1.0 0.0 6.5 2742 2275 A 124 TYR H A 124 TYR HE1 1.0 0.0 6.5 2743 2276 A 124 TYR H A 124 TYR HE2 1.0 0.0 6.5 2744 2277 A 124 TYR H A 124 TYR HBy 1.0 0.0 5.5 2745 2277 A 124 TYR HBx A 124 TYR H 1.0 0.0 5.5 2746 2278 A 125 ILE H A 124 TYR H 1.0 0.0 6.5 2747 2279 A 124 TYR HA A 125 ILE H 1.0 0.0 5.5 2748 2280 A 125 ILE H A 124 TYR HBy 1.0 0.0 6.5 2749 2281 A 125 ILE H A 124 TYR HBx 1.0 0.0 6.5 2750 2282 A 125 ILE H A 124 TYR HD1 1.0 0.0 6.5 2751 2283 A 125 ILE H A 124 TYR HD2 1.0 0.0 6.5 2752 2284 A 125 ILE H A 124 TYR HBy 1.0 0.0 6.5 2753 2284 A 125 ILE H A 124 TYR HBx 1.0 0.0 6.5 2754 2285 A 125 ILE H A 125 ILE HB 1.0 0.0 6.5 2755 2286 A 125 ILE H A 125 ILE HG12 1.0 0.0 6.5 2756 2287 A 125 ILE H A 125 ILE HG13 1.0 0.0 6.5 2757 2288 A 125 ILE H A 125 ILE HD1% 1.0 0.0 6.5 2758 2289 A 125 ILE H A 125 ILE HG2% 1.0 0.0 6.5 2759 2290 A 125 ILE H A 126 GLN H 1.0 0.0 6.5 2760 2291 A 125 ILE HA A 126 GLN H 1.0 0.0 5.5 2761 2292 A 125 ILE HA A 141 LYS HB2 1.0 0.0 6.5 2762 2293 A 125 ILE HA A 141 LYS HB3 1.0 0.0 6.5 2763 2294 A 125 ILE HB A 126 GLN H 1.0 0.0 6.5 2764 2295 A 125 ILE HB A 138 VAL HGy% 1.0 0.0 6.5 2765 2295 A 125 ILE HB A 138 VAL HGx% 1.0 0.0 6.5 2766 2296 A 125 ILE HB A 141 LYS HB2 1.0 0.0 5.5 2767 2297 A 125 ILE HB A 141 LYS HB3 1.0 0.0 6.5 2768 2298 A 125 ILE HG12 A 126 GLN H 1.0 0.0 6.5 2769 2299 A 125 ILE HG12 A 127 ALA H 1.0 0.0 6.5 2770 2300 A 125 ILE HG12 A 127 ALA HB% 1.0 0.0 6.5 2771 2301 A 125 ILE HG12 A 141 LYS HB2 1.0 0.0 6.5 2772 2302 A 125 ILE HG12 A 141 LYS HB3 1.0 0.0 6.5 2773 2303 A 126 GLN H A 125 ILE HG13 1.0 0.0 6.5 2774 2304 A 127 ALA H A 125 ILE HG13 1.0 0.0 6.5 2775 2305 A 127 ALA HB% A 125 ILE HG13 1.0 0.0 6.5 2776 2306 A 141 LYS HB2 A 125 ILE HG13 1.0 0.0 6.5 2777 2307 A 141 LYS HB3 A 125 ILE HG13 1.0 0.0 6.5 2778 2308 A 125 ILE HD1% A 126 GLN H 1.0 0.0 6.5 2779 2309 A 125 ILE HD1% A 127 ALA H 1.0 0.0 6.5 2780 2310 A 125 ILE HD1% A 127 ALA HB% 1.0 0.0 6.5 2781 2311 A 125 ILE HD1% A 141 LYS H 1.0 0.0 6.5 2782 2312 A 125 ILE HD1% A 141 LYS HB2 1.0 0.0 6.5 2783 2313 A 125 ILE HD1% A 141 LYS HB3 1.0 0.0 6.5 2784 2314 A 125 ILE HG12 A 138 VAL HGy% 1.0 0.0 6.5 2785 2314 A 125 ILE HG13 A 138 VAL HGy% 1.0 0.0 6.5 2786 2314 A 138 VAL HGx% A 125 ILE HG13 1.0 0.0 6.5 2787 2314 A 125 ILE HG12 A 138 VAL HGx% 1.0 0.0 6.5 2788 2315 A 125 ILE HG2% A 126 GLN H 1.0 0.0 6.5 2789 2316 A 125 ILE HG2% A 127 ALA H 1.0 0.0 6.5 2790 2317 A 125 ILE HG2% A 127 ALA HB% 1.0 0.0 6.5 2791 2318 A 125 ILE HG2% A 141 LYS HB2 1.0 0.0 6.5 2792 2319 A 125 ILE HG2% A 141 LYS HB3 1.0 0.0 6.5 2793 2320 A 126 GLN HB2 A 126 GLN H 1.0 0.0 6.5 2794 2321 A 126 GLN H A 126 GLN HB3 1.0 0.0 6.5 2795 2322 A 126 GLN HG2 A 126 GLN H 1.0 0.0 6.5 2796 2323 A 126 GLN HG3 A 126 GLN H 1.0 0.0 6.5 2797 2324 A 127 ALA H A 126 GLN H 1.0 0.0 6.5 2798 2325 A 126 GLN HA A 127 ALA H 1.0 0.0 5.5 2799 2326 A 127 ALA H A 126 GLN HB2 1.0 0.0 6.5 2800 2327 A 126 GLN HB2 A 128 THR HA 1.0 0.0 6.5 2801 2328 A 127 ALA H A 126 GLN HB3 1.0 0.0 6.5 2802 2329 A 128 THR HA A 126 GLN HB3 1.0 0.0 6.5 2803 2330 A 126 GLN HG2 A 127 ALA H 1.0 0.0 6.5 2804 2331 A 126 GLN HG2 A 128 THR H 1.0 0.0 6.5 2805 2332 A 126 GLN HG2 A 128 THR HA 1.0 0.0 6.5 2806 2333 A 126 GLN HG2 A 128 THR HB 1.0 0.0 6.5 2807 2334 A 126 GLN HG2 A 128 THR HG2% 1.0 0.0 6.5 2808 2335 A 126 GLN HG3 A 127 ALA H 1.0 0.0 6.5 2809 2336 A 126 GLN HG3 A 128 THR H 1.0 0.0 6.5 2810 2337 A 126 GLN HG3 A 128 THR HA 1.0 0.0 6.5 2811 2338 A 126 GLN HG3 A 128 THR HB 1.0 0.0 6.5 2812 2339 A 126 GLN HG3 A 128 THR HG2% 1.0 0.0 6.5 2813 2340 A 127 ALA HB% A 127 ALA H 1.0 0.0 6.5 2814 2341 A 127 ALA H A 128 THR H 1.0 0.0 6.5 2815 2342 A 128 THR H A 127 ALA HA 1.0 0.0 6.5 2816 2343 A 128 THR HG2% A 127 ALA HA 1.0 0.0 6.5 2817 2344 A 127 ALA HA A 129 ASP H 1.0 0.0 6.5 2818 2345 A 127 ALA HA A 132 GLU HA 1.0 0.0 6.5 2819 2346 A 127 ALA HA A 132 GLU HB2 1.0 0.0 5.5 2820 2347 A 127 ALA HA A 132 GLU HB3 1.0 0.0 5.5 2821 2348 A 127 ALA HA A 132 GLU HG2 1.0 0.0 6.5 2822 2349 A 127 ALA HA A 132 GLU HG3 1.0 0.0 5.5 2823 2350 A 133 ALA H A 127 ALA HA 1.0 0.0 6.5 2824 2351 A 133 ALA HA A 127 ALA HA 1.0 0.0 6.5 2825 2352 A 133 ALA HB% A 127 ALA HA 1.0 0.0 6.5 2826 2353 A 127 ALA HA A 138 VAL HGy% 1.0 0.0 6.5 2827 2353 A 138 VAL HGx% A 127 ALA HA 1.0 0.0 6.5 2828 2354 A 127 ALA HB% A 128 THR H 1.0 0.0 6.5 2829 2355 A 127 ALA HB% A 129 ASP H 1.0 0.0 6.5 2830 2356 A 127 ALA HB% A 132 GLU H 1.0 0.0 6.5 2831 2357 A 127 ALA HB% A 132 GLU HA 1.0 0.0 6.5 2832 2358 A 127 ALA HB% A 132 GLU HB2 1.0 0.0 6.5 2833 2359 A 127 ALA HB% A 132 GLU HB3 1.0 0.0 6.5 2834 2360 A 133 ALA H A 127 ALA HB% 1.0 0.0 6.5 2835 2361 A 133 ALA HA A 127 ALA HB% 1.0 0.0 6.5 2836 2362 A 133 ALA HB% A 127 ALA HB% 1.0 0.0 6.5 2837 2363 A 128 THR HG2% A 128 THR H 1.0 0.0 6.5 2838 2364 A 128 THR H A 129 ASP H 1.0 0.0 6.5 2839 2365 A 128 THR H A 132 GLU HB2 1.0 0.0 6.5 2840 2366 A 128 THR H A 132 GLU HB3 1.0 0.0 6.5 2841 2367 A 128 THR H A 132 GLU HG2 1.0 0.0 6.5 2842 2368 A 128 THR H A 132 GLU HG3 1.0 0.0 6.5 2843 2369 A 128 THR HB A 129 ASP H 1.0 0.0 6.5 2844 2370 A 128 THR HG2% A 129 ASP H 1.0 0.0 6.5 2845 2371 A 128 THR HG2% A 131 SER HB3 1.0 0.0 6.5 2846 2371 A 128 THR HG2% A 131 SER HB2 1.0 0.0 6.5 2847 2372 A 129 ASP H A 129 ASP HBy 1.0 0.0 6.5 2848 2373 A 129 ASP HBx A 129 ASP H 1.0 0.0 6.5 2849 2374 A 129 ASP H A 130 LEU H 1.0 0.0 6.5 2850 2375 A 129 ASP H A 132 GLU HB2 1.0 0.0 6.5 2851 2376 A 129 ASP H A 132 GLU HB3 1.0 0.0 6.5 2852 2377 A 129 ASP H A 132 GLU HG2 1.0 0.0 6.5 2853 2378 A 129 ASP H A 132 GLU HG3 1.0 0.0 6.5 2854 2379 A 129 ASP HA A 130 LEU H 1.0 0.0 5.5 2855 2380 A 129 ASP HA A 131 SER H 1.0 0.0 6.5 2856 2381 A 130 LEU H A 129 ASP HBy 1.0 0.0 6.5 2857 2382 A 131 SER H A 129 ASP HBy 1.0 0.0 6.5 2858 2383 A 129 ASP HBx A 130 LEU H 1.0 0.0 6.5 2859 2384 A 129 ASP HBx A 131 SER H 1.0 0.0 6.5 2860 2385 A 130 LEU H A 129 ASP HBy 1.0 0.0 5.5 2861 2385 A 129 ASP HBx A 130 LEU H 1.0 0.0 5.5 2862 2386 A 131 SER H A 129 ASP HBy 1.0 0.0 6.5 2863 2386 A 129 ASP HBx A 131 SER H 1.0 0.0 6.5 2864 2387 A 130 LEU H A 130 LEU HB2 1.0 0.0 5.5 2865 2388 A 130 LEU H A 130 LEU HB3 1.0 0.0 6.5 2866 2389 A 130 LEU H A 130 LEU HG 1.0 0.0 6.5 2867 2390 A 130 LEU HDx% A 130 LEU H 1.0 0.0 6.5 2868 2391 A 130 LEU H A 130 LEU HDy% 1.0 0.0 6.5 2869 2392 A 130 LEU H A 131 SER H 1.0 0.0 6.5 2870 2393 A 132 GLU H A 130 LEU H 1.0 0.0 6.5 2871 2394 A 130 LEU HA A 132 GLU H 1.0 0.0 6.5 2872 2395 A 133 ALA H A 130 LEU HA 1.0 0.0 6.5 2873 2396 A 133 ALA HB% A 130 LEU HA 1.0 0.0 6.5 2874 2397 A 131 SER H A 130 LEU HB2 1.0 0.0 6.5 2875 2398 A 131 SER H A 130 LEU HB3 1.0 0.0 6.5 2876 2399 A 131 SER H A 130 LEU HG 1.0 0.0 6.5 2877 2400 A 130 LEU HDx% A 131 SER H 1.0 0.0 6.5 2878 2401 A 133 ALA H A 130 LEU HDx% 1.0 0.0 6.5 2879 2402 A 133 ALA HB% A 130 LEU HDx% 1.0 0.0 6.5 2880 2403 A 131 SER H A 130 LEU HDy% 1.0 0.0 6.5 2881 2404 A 133 ALA H A 130 LEU HDy% 1.0 0.0 6.5 2882 2405 A 133 ALA HB% A 130 LEU HDy% 1.0 0.0 6.5 2883 2406 A 131 SER H A 130 LEU HDy% 1.0 0.0 6.5 2884 2406 A 130 LEU HDx% A 131 SER H 1.0 0.0 6.5 2885 2407 A 133 ALA H A 130 LEU HDy% 1.0 0.0 6.5 2886 2407 A 133 ALA H A 130 LEU HDx% 1.0 0.0 6.5 2887 2408 A 133 ALA HA A 130 LEU HDy% 1.0 0.0 6.5 2888 2408 A 133 ALA HA A 130 LEU HDx% 1.0 0.0 6.5 2889 2409 A 133 ALA HB% A 130 LEU HDy% 1.0 0.0 6.5 2890 2409 A 133 ALA HB% A 130 LEU HDx% 1.0 0.0 6.5 2891 2410 A 131 SER HB2 A 131 SER H 1.0 0.0 6.5 2892 2411 A 131 SER H A 131 SER HB3 1.0 0.0 6.5 2893 2412 A 132 GLU H A 131 SER H 1.0 0.0 6.5 2894 2413 A 133 ALA H A 131 SER H 1.0 0.0 6.5 2895 2414 A 133 ALA H A 131 SER HA 1.0 0.0 6.5 2896 2415 A 134 SER H A 131 SER HA 1.0 0.0 6.5 2897 2416 A 132 GLU H A 131 SER HB2 1.0 0.0 6.5 2898 2417 A 132 GLU H A 131 SER HB3 1.0 0.0 6.5 2899 2418 A 133 ALA HB% A 131 SER HB3 1.0 0.0 6.5 2900 2418 A 133 ALA HB% A 131 SER HB2 1.0 0.0 6.5 2901 2419 A 132 GLU HB2 A 132 GLU H 1.0 0.0 6.5 2902 2420 A 132 GLU HB3 A 132 GLU H 1.0 0.0 6.5 2903 2421 A 132 GLU HG2 A 132 GLU H 1.0 0.0 6.5 2904 2422 A 132 GLU HG3 A 132 GLU H 1.0 0.0 6.5 2905 2423 A 133 ALA H A 132 GLU H 1.0 0.0 5.5 2906 2424 A 133 ALA HB% A 132 GLU H 1.0 0.0 6.5 2907 2425 A 134 SER H A 132 GLU H 1.0 0.0 6.5 2908 2426 A 133 ALA H A 132 GLU HA 1.0 0.0 5.5 2909 2427 A 134 SER H A 132 GLU HA 1.0 0.0 6.5 2910 2428 A 132 GLU HA A 137 ALA HB% 1.0 0.0 6.5 2911 2429 A 133 ALA H A 132 GLU HB2 1.0 0.0 6.5 2912 2430 A 134 SER H A 132 GLU HB2 1.0 0.0 6.5 2913 2431 A 133 ALA H A 132 GLU HB3 1.0 0.0 6.5 2914 2432 A 134 SER H A 132 GLU HB3 1.0 0.0 6.5 2915 2433 A 133 ALA H A 132 GLU HG2 1.0 0.0 6.5 2916 2434 A 133 ALA H A 132 GLU HG3 1.0 0.0 6.5 2917 2435 A 133 ALA H A 133 ALA HB% 1.0 0.0 6.5 2918 2436 A 133 ALA H A 134 SER H 1.0 0.0 6.5 2919 2437 A 133 ALA H A 137 ALA HB% 1.0 0.0 6.5 2920 2438 A 133 ALA HB% A 134 SER H 1.0 0.0 6.5 2921 2439 A 133 ALA HB% A 138 VAL HA 1.0 0.0 6.5 2922 2440 A 133 ALA HB% A 138 VAL HB 1.0 0.0 6.5 2923 2441 A 135 ARG H A 134 SER H 1.0 0.0 6.5 2924 2442 A 134 SER H A 136 GLU H 1.0 0.0 6.5 2925 2443 A 134 SER H A 137 ALA H 1.0 0.0 6.5 2926 2444 A 134 SER H A 137 ALA HB% 1.0 0.0 6.5 2927 2445 A 134 SER H A 138 VAL HB 1.0 0.0 6.5 2928 2446 A 134 SER H A 138 VAL HGy% 1.0 0.0 6.5 2929 2446 A 134 SER H A 138 VAL HGx% 1.0 0.0 6.5 2930 2447 A 135 ARG H A 134 SER HA 1.0 0.0 5.5 2931 2448 A 134 SER HA A 136 GLU H 1.0 0.0 6.5 2932 2449 A 134 SER HA A 137 ALA H 1.0 0.0 6.5 2933 2450 A 134 SER HB3 A 136 GLU HBx 1.0 0.0 5.5 2934 2450 A 136 GLU HBy A 134 SER HB2 1.0 0.0 5.5 2935 2450 A 134 SER HB3 A 136 GLU HBy 1.0 0.0 5.5 2936 2450 A 134 SER HB2 A 136 GLU HBx 1.0 0.0 5.5 2937 2451 A 135 ARG HBy A 135 ARG H 1.0 0.0 6.5 2938 2452 A 135 ARG H A 135 ARG HBx 1.0 0.0 5.0 2939 2453 A 135 ARG HD2 A 135 ARG H 1.0 0.0 6.5 2940 2454 A 135 ARG HD3 A 135 ARG H 1.0 0.0 6.5 2941 2455 A 135 ARG H A 135 ARG HG2 1.0 0.0 6.5 2942 2456 A 135 ARG HG3 A 135 ARG H 1.0 0.0 6.5 2943 2457 A 135 ARG H A 136 GLU H 1.0 0.0 6.5 2944 2458 A 135 ARG H A 136 GLU HA 1.0 0.0 6.5 2945 2459 A 135 ARG H A 136 GLU HBy 1.0 0.0 6.5 2946 2460 A 135 ARG H A 136 GLU HBx 1.0 0.0 6.5 2947 2461 A 135 ARG H A 137 ALA H 1.0 0.0 6.5 2948 2462 A 135 ARG H A 138 VAL HGy% 1.0 0.0 6.5 2949 2462 A 135 ARG H A 138 VAL HGx% 1.0 0.0 6.5 2950 2463 A 137 ALA H A 135 ARG HA 1.0 0.0 6.5 2951 2464 A 135 ARG HA A 138 VAL H 1.0 0.0 6.5 2952 2465 A 138 VAL HA A 135 ARG HA 1.0 0.0 6.5 2953 2466 A 139 GLU H A 135 ARG HA 1.0 0.0 6.5 2954 2467 A 135 ARG HBy A 136 GLU H 1.0 0.0 6.5 2955 2468 A 136 GLU H A 135 ARG HBx 1.0 0.0 6.5 2956 2469 A 135 ARG HD2 A 136 GLU H 1.0 0.0 6.5 2957 2470 A 135 ARG HD3 A 136 GLU H 1.0 0.0 6.5 2958 2471 A 136 GLU H A 135 ARG HG2 1.0 0.0 6.5 2959 2472 A 135 ARG HG3 A 136 GLU H 1.0 0.0 6.5 2960 2473 A 136 GLU H A 136 GLU HBy 1.0 0.0 6.5 2961 2474 A 136 GLU H A 136 GLU HBx 1.0 0.0 6.5 2962 2475 A 136 GLU H A 136 GLU HGy 1.0 0.0 6.5 2963 2476 A 136 GLU H A 136 GLU HGx 1.0 0.0 6.5 2964 2477 A 136 GLU H A 136 GLU HBx 1.0 0.0 5.5 2965 2477 A 136 GLU H A 136 GLU HBy 1.0 0.0 5.5 2966 2478 A 136 GLU H A 136 GLU HGx 1.0 0.0 6.5 2967 2478 A 136 GLU H A 136 GLU HGy 1.0 0.0 6.5 2968 2479 A 136 GLU H A 137 ALA H 1.0 0.0 6.5 2969 2480 A 136 GLU H A 138 VAL H 1.0 0.0 6.5 2970 2481 A 136 GLU HA A 138 VAL H 1.0 0.0 6.5 2971 2482 A 139 GLU H A 136 GLU HA 1.0 0.0 6.5 2972 2483 A 136 GLU HA A 140 GLU H 1.0 0.0 6.5 2973 2484 A 137 ALA H A 136 GLU HBy 1.0 0.0 6.5 2974 2485 A 137 ALA H A 136 GLU HBx 1.0 0.0 6.5 2975 2486 A 137 ALA H A 136 GLU HGy 1.0 0.0 6.5 2976 2487 A 137 ALA H A 136 GLU HGx 1.0 0.0 6.5 2977 2488 A 137 ALA H A 136 GLU HBx 1.0 0.0 5.5 2978 2488 A 137 ALA H A 136 GLU HBy 1.0 0.0 5.5 2979 2489 A 139 GLU H A 136 GLU HBx 1.0 0.0 6.5 2980 2489 A 139 GLU H A 136 GLU HBy 1.0 0.0 6.5 2981 2490 A 137 ALA H A 136 GLU HGx 1.0 0.0 6.5 2982 2490 A 137 ALA H A 136 GLU HGy 1.0 0.0 6.5 2983 2491 A 137 ALA HB% A 137 ALA H 1.0 0.0 6.5 2984 2492 A 137 ALA H A 138 VAL H 1.0 0.0 5.5 2985 2493 A 139 GLU H A 137 ALA H 1.0 0.0 6.5 2986 2494 A 137 ALA H A 140 GLU H 1.0 0.0 6.5 2987 2495 A 139 GLU H A 137 ALA HA 1.0 0.0 6.5 2988 2496 A 140 GLU H A 137 ALA HA 1.0 0.0 5.5 2989 2497 A 141 LYS H A 137 ALA HA 1.0 0.0 6.5 2990 2498 A 137 ALA HB% A 138 VAL H 1.0 0.0 6.5 2991 2499 A 137 ALA HB% A 140 GLU H 1.0 0.0 6.5 2992 2500 A 137 ALA HB% A 140 GLU HB2 1.0 0.0 6.5 2993 2501 A 137 ALA HB% A 140 GLU HB3 1.0 0.0 6.5 2994 2502 A 137 ALA HB% A 140 GLU HG2 1.0 0.0 6.5 2995 2503 A 137 ALA HB% A 140 GLU HG3 1.0 0.0 6.5 2996 2504 A 141 LYS H A 137 ALA HB% 1.0 0.0 6.5 2997 2505 A 139 GLU H A 138 VAL H 1.0 0.0 6.5 2998 2506 A 138 VAL H A 140 GLU H 1.0 0.0 6.5 2999 2507 A 138 VAL HA A 140 GLU H 1.0 0.0 6.5 3000 2508 A 141 LYS H A 138 VAL HA 1.0 0.0 6.5 3001 2509 A 138 VAL HA A 142 LEU H 1.0 0.0 6.5 3002 2510 A 138 VAL HA A 142 LEU HDy% 1.0 0.0 6.5 3003 2510 A 142 LEU HDx% A 138 VAL HA 1.0 0.0 6.5 3004 2511 A 139 GLU H A 138 VAL HB 1.0 0.0 6.5 3005 2512 A 141 LYS H A 138 VAL HB 1.0 0.0 6.5 3006 2513 A 138 VAL HGx% A 142 LEU HG 1.0 0.0 6.5 3007 2514 A 142 LEU HG A 138 VAL HGy% 1.0 0.0 6.5 3008 2515 A 139 GLU H A 138 VAL HGy% 1.0 0.0 6.5 3009 2515 A 139 GLU H A 138 VAL HGx% 1.0 0.0 6.5 3010 2516 A 138 VAL HGx% A 142 LEU HBx 1.0 0.0 6.5 3011 2516 A 138 VAL HGy% A 142 LEU HBx 1.0 0.0 6.5 3012 2516 A 142 LEU HBy A 138 VAL HGy% 1.0 0.0 6.5 3013 2516 A 138 VAL HGx% A 142 LEU HBy 1.0 0.0 6.5 3014 2517 A 139 GLU H A 139 GLU HBy 1.0 0.0 6.5 3015 2518 A 139 GLU H A 139 GLU HBx 1.0 0.0 6.5 3016 2519 A 139 GLU H A 139 GLU HGx 1.0 0.0 5.5 3017 2519 A 139 GLU H A 139 GLU HGy 1.0 0.0 5.5 3018 2520 A 139 GLU H A 140 GLU H 1.0 0.0 6.5 3019 2521 A 139 GLU H A 141 LYS H 1.0 0.0 6.5 3020 2522 A 140 GLU H A 139 GLU HA 1.0 0.0 5.5 3021 2523 A 141 LYS H A 139 GLU HA 1.0 0.0 6.5 3022 2524 A 142 LEU H A 139 GLU HA 1.0 0.0 6.5 3023 2525 A 139 GLU HA A 143 ARG H 1.0 0.0 6.5 3024 2526 A 140 GLU H A 139 GLU HBy 1.0 0.0 6.5 3025 2527 A 140 GLU H A 139 GLU HBx 1.0 0.0 6.5 3026 2528 A 140 GLU H A 139 GLU HGy 1.0 0.0 6.5 3027 2529 A 140 GLU H A 139 GLU HGx 1.0 0.0 6.5 3028 2530 A 140 GLU H A 140 GLU HB2 1.0 0.0 6.5 3029 2531 A 140 GLU H A 140 GLU HB3 1.0 0.0 5.5 3030 2532 A 140 GLU H A 140 GLU HG2 1.0 0.0 6.5 3031 2533 A 140 GLU H A 140 GLU HG3 1.0 0.0 6.5 3032 2534 A 141 LYS H A 140 GLU H 1.0 0.0 5.5 3033 2535 A 140 GLU H A 142 LEU H 1.0 0.0 6.5 3034 2536 A 142 LEU H A 140 GLU HA 1.0 0.0 6.5 3035 2537 A 143 ARG H A 140 GLU HA 1.0 0.0 6.5 3036 2538 A 140 GLU HA A 143 ARG HD2 1.0 0.0 6.5 3037 2539 A 140 GLU HA A 143 ARG HD3 1.0 0.0 6.5 3038 2540 A 140 GLU HA A 144 ALA H 1.0 0.0 6.5 3039 2541 A 141 LYS H A 140 GLU HB2 1.0 0.0 6.5 3040 2542 A 140 GLU HB2 A 142 LEU H 1.0 0.0 6.5 3041 2543 A 140 GLU HB2 A 143 ARG H 1.0 0.0 6.5 3042 2544 A 140 GLU HB2 A 144 ALA H 1.0 0.0 6.5 3043 2545 A 141 LYS H A 140 GLU HB3 1.0 0.0 6.5 3044 2546 A 140 GLU HB3 A 142 LEU H 1.0 0.0 6.5 3045 2547 A 140 GLU HB3 A 143 ARG H 1.0 0.0 6.5 3046 2548 A 140 GLU HB3 A 144 ALA H 1.0 0.0 6.5 3047 2549 A 141 LYS H A 140 GLU HG2 1.0 0.0 6.5 3048 2550 A 140 GLU HG2 A 143 ARG H 1.0 0.0 6.5 3049 2551 A 141 LYS H A 140 GLU HG3 1.0 0.0 6.5 3050 2552 A 140 GLU HG3 A 143 ARG H 1.0 0.0 6.5 3051 2553 A 141 LYS H A 141 LYS HA 1.0 0.0 5.0 3052 2554 A 141 LYS H A 141 LYS HD2 1.0 0.0 6.5 3053 2555 A 141 LYS H A 141 LYS HD3 1.0 0.0 6.5 3054 2556 A 141 LYS H A 141 LYS HE2 1.0 0.0 6.5 3055 2557 A 141 LYS H A 141 LYS HE3 1.0 0.0 6.5 3056 2558 A 141 LYS H A 141 LYS HG2 1.0 0.0 5.5 3057 2559 A 141 LYS H A 141 LYS HG3 1.0 0.0 5.5 3058 2560 A 141 LYS H A 142 LEU H 1.0 0.0 5.5 3059 2561 A 141 LYS H A 143 ARG H 1.0 0.0 6.5 3060 2562 A 143 ARG H A 141 LYS HA 1.0 0.0 6.5 3061 2563 A 144 ALA H A 141 LYS HA 1.0 0.0 5.5 3062 2564 A 141 LYS HA A 144 ALA HB% 1.0 0.0 5.5 3063 2565 A 141 LYS HA A 145 THR H 1.0 0.0 6.5 3064 2566 A 141 LYS HB2 A 144 ALA HB% 1.0 0.0 6.5 3065 2567 A 141 LYS HB3 A 144 ALA HB% 1.0 0.0 6.5 3066 2568 A 141 LYS HD2 A 142 LEU H 1.0 0.0 6.5 3067 2569 A 141 LYS HD3 A 142 LEU H 1.0 0.0 6.5 3068 2570 A 142 LEU H A 141 LYS HE2 1.0 0.0 6.5 3069 2571 A 142 LEU H A 141 LYS HE3 1.0 0.0 6.5 3070 2572 A 142 LEU H A 142 LEU HBy 1.0 0.0 6.5 3071 2573 A 142 LEU H A 142 LEU HBx 1.0 0.0 6.5 3072 2574 A 142 LEU H A 142 LEU HG 1.0 0.0 6.5 3073 2575 A 142 LEU H A 142 LEU HBx 1.0 0.0 5.5 3074 2575 A 142 LEU H A 142 LEU HBy 1.0 0.0 5.5 3075 2576 A 142 LEU HDx% A 142 LEU H 1.0 0.0 6.5 3076 2577 A 142 LEU H A 142 LEU HDy% 1.0 0.0 6.5 3077 2578 A 142 LEU H A 143 ARG H 1.0 0.0 6.5 3078 2579 A 142 LEU H A 144 ALA H 1.0 0.0 6.5 3079 2580 A 142 LEU HA A 144 ALA H 1.0 0.0 6.5 3080 2581 A 142 LEU HA A 145 THR H 1.0 0.0 6.5 3081 2582 A 142 LEU HBy A 143 ARG H 1.0 0.0 6.5 3082 2583 A 143 ARG H A 142 LEU HBx 1.0 0.0 6.5 3083 2584 A 142 LEU HG A 143 ARG H 1.0 0.0 6.5 3084 2585 A 143 ARG H A 142 LEU HBx 1.0 0.0 6.5 3085 2585 A 142 LEU HBy A 143 ARG H 1.0 0.0 6.5 3086 2586 A 142 LEU HDx% A 143 ARG H 1.0 0.0 6.5 3087 2587 A 143 ARG H A 142 LEU HDy% 1.0 0.0 6.5 3088 2588 A 143 ARG HB2 A 143 ARG H 1.0 0.0 6.5 3089 2589 A 143 ARG H A 143 ARG HB3 1.0 0.0 6.5 3090 2590 A 143 ARG H A 143 ARG HD2 1.0 0.0 6.5 3091 2591 A 143 ARG H A 143 ARG HD3 1.0 0.0 6.5 3092 2592 A 143 ARG H A 143 ARG HG2 1.0 0.0 6.5 3093 2593 A 143 ARG H A 143 ARG HG3 1.0 0.0 6.5 3094 2594 A 143 ARG H A 144 ALA H 1.0 0.0 5.5 3095 2595 A 143 ARG H A 145 THR H 1.0 0.0 6.5 3096 2596 A 143 ARG HB2 A 144 ALA H 1.0 0.0 6.5 3097 2597 A 143 ARG HB2 A 146 ASP H 1.0 0.0 6.5 3098 2598 A 144 ALA H A 143 ARG HB3 1.0 0.0 6.5 3099 2599 A 146 ASP H A 143 ARG HB3 1.0 0.0 6.5 3100 2600 A 143 ARG HD2 A 144 ALA H 1.0 0.0 6.5 3101 2601 A 143 ARG HD3 A 144 ALA H 1.0 0.0 6.5 3102 2602 A 144 ALA H A 143 ARG HG2 1.0 0.0 6.5 3103 2603 A 144 ALA H A 143 ARG HG3 1.0 0.0 6.5 3104 2604 A 144 ALA H A 144 ALA HB% 1.0 0.0 6.5 3105 2605 A 144 ALA H A 145 THR H 1.0 0.0 6.5 3106 2606 A 144 ALA H A 146 ASP H 1.0 0.0 6.5 3107 2607 A 145 THR H A 144 ALA HA 1.0 0.0 5.5 3108 2608 A 144 ALA HA A 145 THR HA 1.0 0.0 6.5 3109 2609 A 145 THR HB A 144 ALA HA 1.0 0.0 6.5 3110 2610 A 145 THR HG2% A 144 ALA HA 1.0 0.0 6.5 3111 2611 A 146 ASP H A 144 ALA HA 1.0 0.0 6.5 3112 2612 A 144 ALA HB% A 145 THR H 1.0 0.0 6.5 3113 2613 A 144 ALA HB% A 145 THR HA 1.0 0.0 6.5 3114 2614 A 145 THR HB A 144 ALA HB% 1.0 0.0 6.5 3115 2615 A 144 ALA HB% A 146 ASP H 1.0 0.0 6.5 3116 2616 A 145 THR HB A 145 THR H 1.0 0.0 6.5 3117 2617 A 145 THR HG2% A 145 THR H 1.0 0.0 6.5 3118 2618 A 145 THR H A 146 ASP H 1.0 0.0 6.5 3119 2619 A 145 THR H A 146 ASP HB2 1.0 0.0 6.5 3120 2620 A 145 THR H A 146 ASP HB3 1.0 0.0 6.5 3121 2621 A 145 THR HA A 146 ASP HA 1.0 0.0 6.5 3122 2622 A 145 THR HB A 146 ASP H 1.0 0.0 6.5 3123 2623 A 145 THR HG2% A 146 ASP H 1.0 0.0 6.5 3124 2624 A 145 THR HG2% A 146 ASP HA 1.0 0.0 6.5 3125 2625 A 146 ASP H A 146 ASP HB2 1.0 0.0 5.5 3126 2626 A 146 ASP H A 146 ASP HB3 1.0 0.0 6.5 3127 2627 A 146 ASP H A 147 ARG H 1.0 0.0 6.5 3128 2628 A 146 ASP HA A 147 ARG H 1.0 0.0 5.5 3129 2629 A 146 ASP HB2 A 147 ARG H 1.0 0.0 6.5 3130 2630 A 146 ASP HB2 A 148 GLN H 1.0 0.0 6.5 3131 2631 A 146 ASP HB3 A 147 ARG H 1.0 0.0 6.5 3132 2632 A 146 ASP HB3 A 148 GLN H 1.0 0.0 6.5 3133 2633 A 147 ARG H A 147 ARG HBy 1.0 0.0 6.5 3134 2634 A 147 ARG H A 147 ARG HBx 1.0 0.0 6.5 3135 2635 A 147 ARG H A 147 ARG HD2 1.0 0.0 6.5 3136 2636 A 147 ARG H A 147 ARG HD3 1.0 0.0 6.5 3137 2637 A 147 ARG H A 147 ARG HGx 1.0 0.0 6.5 3138 2638 A 147 ARG H A 147 ARG HGy 1.0 0.0 6.5 3139 2639 A 147 ARG H A 147 ARG HBx 1.0 0.0 5.5 3140 2639 A 147 ARG H A 147 ARG HBy 1.0 0.0 5.5 3141 2640 A 147 ARG H A 148 GLN H 1.0 0.0 6.5 3142 2641 A 148 GLN H A 147 ARG HA 1.0 0.0 5.0 3143 2642 A 148 GLN H A 147 ARG HBy 1.0 0.0 6.5 3144 2643 A 148 GLN H A 147 ARG HBx 1.0 0.0 6.5 3145 2644 A 148 GLN H A 147 ARG HGx 1.0 0.0 6.5 3146 2645 A 148 GLN H A 147 ARG HGy 1.0 0.0 6.5 3147 2646 A 148 GLN H A 147 ARG HBx 1.0 0.0 6.5 3148 2646 A 148 GLN H A 147 ARG HBy 1.0 0.0 6.5 3149 2647 A 148 GLN H A 148 GLN HBy 1.0 0.0 6.5 3150 2648 A 148 GLN H A 148 GLN HBx 1.0 0.0 6.5 3151 2649 A 148 GLN H A 148 GLN HG2 1.0 0.0 6.5 3152 2650 A 148 GLN H A 148 GLN HG3 1.0 0.0 6.5 3153 2651 A 148 GLN H A 148 GLN HBx 1.0 0.0 5.5 3154 2651 A 148 GLN H A 148 GLN HBy 1.0 0.0 5.5 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 GLY C A 5 VAL N A 5 VAL CA A 5 VAL C 1.0 -138.3 -81.7 PHI 2 2 A 5 VAL N A 5 VAL CA A 5 VAL C A 6 THR N 1.0 124.6 174.7 PSI 3 3 A 5 VAL C A 6 THR N A 6 THR CA A 6 THR C 1.0 -173.0 -100.4 PHI 4 4 A 6 THR N A 6 THR CA A 6 THR C A 7 VAL N 1.0 96.1 150.0 PSI 5 5 A 6 THR C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -137.2 -76.9 PHI 6 6 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 SER N 1.0 103.3 143.3 PSI 7 7 A 7 VAL C A 8 SER N A 8 SER CA A 8 SER C 1.0 -173.6 -33.6 PHI 8 8 A 8 SER N A 8 SER CA A 8 SER C A 9 ASP N 1.0 90.5 181.4 PSI 9 9 A 8 SER C A 9 ASP N A 9 ASP CA A 9 ASP C 1.0 -79.9 -39.9 PHI 10 10 A 9 ASP N A 9 ASP CA A 9 ASP C A 10 VAL N 1.0 -57.3 -17.3 PSI 11 11 A 9 ASP C A 10 VAL N A 10 VAL CA A 10 VAL C 1.0 -81.1 -41.1 PHI 12 12 A 10 VAL N A 10 VAL CA A 10 VAL C A 11 CYS N 1.0 -61.3 -21.3 PSI 13 13 A 10 VAL C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -81.6 -41.6 PHI 14 14 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 LYS N 1.0 -66.7 -26.7 PSI 15 15 A 11 CYS C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -81.4 -41.4 PHI 16 16 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 THR N 1.0 -59.2 -19.2 PSI 17 17 A 12 LYS C A 13 THR N A 13 THR CA A 13 THR C 1.0 -89.3 -49.3 PHI 18 18 A 13 THR N A 13 THR CA A 13 THR C A 14 THR N 1.0 -60.2 -20.2 PSI 19 19 A 13 THR C A 14 THR N A 14 THR CA A 14 THR C 1.0 -86.3 -46.3 PHI 20 20 A 14 THR N A 14 THR CA A 14 THR C A 15 TYR N 1.0 -61.2 -21.2 PSI 21 21 A 14 THR C A 15 TYR N A 15 TYR CA A 15 TYR C 1.0 -80.5 -40.5 PHI 22 22 A 15 TYR N A 15 TYR CA A 15 TYR C A 16 GLU N 1.0 -62.7 -22.7 PSI 23 23 A 15 TYR C A 16 GLU N A 16 GLU CA A 16 GLU C 1.0 -80.5 -40.5 PHI 24 24 A 16 GLU N A 16 GLU CA A 16 GLU C A 17 GLU N 1.0 -60.0 -20.0 PSI 25 25 A 16 GLU C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -83.9 -43.9 PHI 26 26 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 ILE N 1.0 -59.2 -19.2 PSI 27 27 A 17 GLU C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -86.9 -46.9 PHI 28 28 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 LYS N 1.0 -60.4 -20.4 PSI 29 29 A 18 ILE C A 19 LYS N A 19 LYS CA A 19 LYS C 1.0 -79.1 -39.1 PHI 30 30 A 19 LYS N A 19 LYS CA A 19 LYS C A 20 LYS N 1.0 -65.1 -25.1 PSI 31 31 A 19 LYS C A 20 LYS N A 20 LYS CA A 20 LYS C 1.0 -96.0 -54.7 PHI 32 32 A 20 LYS N A 20 LYS CA A 20 LYS C A 21 ASP N 1.0 -57.5 -17.5 PSI 33 33 A 20 LYS C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -121.8 -64.4 PHI 34 34 A 21 ASP N A 21 ASP CA A 21 ASP C A 22 LYS N 1.0 -27.9 17.2 PSI 35 35 A 21 ASP C A 22 LYS N A 22 LYS CA A 22 LYS C 1.0 38.2 78.2 PHI 36 36 A 22 LYS N A 22 LYS CA A 22 LYS C A 23 LYS N 1.0 15.9 55.9 PSI 37 37 A 22 LYS C A 23 LYS N A 23 LYS CA A 23 LYS C 1.0 -118.7 -56.6 PHI 38 38 A 23 LYS N A 23 LYS CA A 23 LYS C A 24 HIS N 1.0 -44.9 15.4 PSI 39 39 A 25 ARG C A 26 TYR N A 26 TYR CA A 26 TYR C 1.0 -158.6 -109.2 PHI 40 40 A 26 TYR N A 26 TYR CA A 26 TYR C A 27 VAL N 1.0 116.7 200.8 PSI 41 41 A 26 TYR C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -142.2 -102.2 PHI 42 42 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 ILE N 1.0 107.0 167.6 PSI 43 43 A 27 VAL C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -132.6 -92.6 PHI 44 44 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 PHE N 1.0 105.5 145.5 PSI 45 45 A 28 ILE C A 29 PHE N A 29 PHE CA A 29 PHE C 1.0 -145.9 -80.6 PHI 46 46 A 29 PHE N A 29 PHE CA A 29 PHE C A 30 TYR N 1.0 116.5 168.1 PSI 47 47 A 29 PHE C A 30 TYR N A 30 TYR CA A 30 TYR C 1.0 -155.1 -97.8 PHI 48 48 A 30 TYR N A 30 TYR CA A 30 TYR C A 31 ILE N 1.0 119.4 171.1 PSI 49 49 A 30 TYR C A 31 ILE N A 31 ILE CA A 31 ILE C 1.0 -148.1 -50.0 PHI 50 50 A 31 ILE N A 31 ILE CA A 31 ILE C A 32 ARG N 1.0 102.5 142.5 PSI 51 51 A 31 ILE C A 32 ARG N A 32 ARG CA A 32 ARG C 1.0 -147.2 -56.8 PHI 52 52 A 32 ARG N A 32 ARG CA A 32 ARG C A 33 ASP N 1.0 72.1 154.1 PSI 53 53 A 33 ASP C A 34 GLU N A 34 GLU CA A 34 GLU C 1.0 43.2 83.2 PHI 54 54 A 34 GLU N A 34 GLU CA A 34 GLU C A 35 LYS N 1.0 -5.9 48.0 PSI 55 55 A 35 LYS C A 36 GLN N A 36 GLN CA A 36 GLN C 1.0 -133.9 -83.9 PHI 56 56 A 36 GLN N A 36 GLN CA A 36 GLN C A 37 ILE N 1.0 90.3 157.4 PSI 57 57 A 36 GLN C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -142.3 -59.8 PHI 58 58 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 ASP N 1.0 77.2 201.8 PSI 59 59 A 37 ILE C A 38 ASP N A 38 ASP CA A 38 ASP C 1.0 -159.0 -119.0 PHI 60 60 A 38 ASP N A 38 ASP CA A 38 ASP C A 39 VAL N 1.0 139.3 179.3 PSI 61 61 A 38 ASP C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -123.1 -57.6 PHI 62 62 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 GLU N 1.0 104.9 147.3 PSI 63 63 A 40 GLU C A 41 THR N A 41 THR CA A 41 THR C 1.0 -180.2 -125.7 PHI 64 64 A 41 THR N A 41 THR CA A 41 THR C A 42 VAL N 1.0 123.1 176.1 PSI 65 65 A 41 THR C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -143.9 -94.0 PHI 66 66 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 ALA N 1.0 110.1 154.3 PSI 67 67 A 42 VAL C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -181.0 -41.0 PHI 68 68 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 ASP N 1.0 110.4 178.1 PSI 69 69 A 44 ASP C A 45 ARG N A 45 ARG CA A 45 ARG C 1.0 -104.0 -42.3 PHI 70 70 A 45 ARG N A 45 ARG CA A 45 ARG C A 46 ASN N 1.0 -61.1 27.4 PSI 71 71 A 46 ASN C A 47 ALA N A 47 ALA CA A 47 ALA C 1.0 -117.5 -45.0 PHI 72 72 A 47 ALA N A 47 ALA CA A 47 ALA C A 48 GLU N 1.0 84.7 224.7 PSI 73 73 A 47 ALA C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -113.4 -62.0 PHI 74 74 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 TYR N 1.0 143.0 183.0 PSI 75 75 A 48 GLU C A 49 TYR N A 49 TYR CA A 49 TYR C 1.0 -82.7 -42.7 PHI 76 76 A 49 TYR N A 49 TYR CA A 49 TYR C A 50 ASP N 1.0 -60.8 -20.8 PSI 77 77 A 49 TYR C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -86.0 -46.0 PHI 78 78 A 50 ASP N A 50 ASP CA A 50 ASP C A 51 GLN N 1.0 -60.1 -20.1 PSI 79 79 A 50 ASP C A 51 GLN N A 51 GLN CA A 51 GLN C 1.0 -86.1 -46.1 PHI 80 80 A 51 GLN N A 51 GLN CA A 51 GLN C A 52 PHE N 1.0 -59.1 -19.1 PSI 81 81 A 51 GLN C A 52 PHE N A 52 PHE CA A 52 PHE C 1.0 -82.5 -42.5 PHI 82 82 A 52 PHE N A 52 PHE CA A 52 PHE C A 53 LEU N 1.0 -61.6 -21.6 PSI 83 83 A 52 PHE C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -82.5 -42.5 PHI 84 84 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 GLU N 1.0 -59.5 -19.5 PSI 85 85 A 53 LEU C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -82.7 -42.7 PHI 86 86 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 ASP N 1.0 -61.7 -21.7 PSI 87 87 A 54 GLU C A 55 ASP N A 55 ASP CA A 55 ASP C 1.0 -83.8 -43.8 PHI 88 88 A 55 ASP N A 55 ASP CA A 55 ASP C A 56 ILE N 1.0 -58.4 -18.4 PSI 89 89 A 55 ASP C A 56 ILE N A 56 ILE CA A 56 ILE C 1.0 -83.8 -43.8 PHI 90 90 A 56 ILE N A 56 ILE CA A 56 ILE C A 57 GLN N 1.0 -54.9 -14.9 PSI 91 91 A 56 ILE C A 57 GLN N A 57 GLN CA A 57 GLN C 1.0 -130.0 -51.8 PHI 92 92 A 57 GLN N A 57 GLN CA A 57 GLN C A 58 LYS N 1.0 -67.7 12.5 PSI 93 93 A 57 GLN C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -80.7 -40.7 PHI 94 94 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 CYS N 1.0 -53.9 -0.9 PSI 95 95 A 58 LYS C A 59 CYS N A 59 CYS CA A 59 CYS C 1.0 -125.4 -70.1 PHI 96 96 A 59 CYS N A 59 CYS CA A 59 CYS C A 60 GLY N 1.0 -41.0 32.2 PSI 97 97 A 59 CYS C A 60 GLY N A 60 GLY CA A 60 GLY C 1.0 -185.5 -45.5 PHI 98 98 A 60 GLY N A 60 GLY CA A 60 GLY C A 61 PRO N 1.0 61.9 201.9 PSI 99 99 A 62 GLY C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -170.4 -54.4 PHI 100 100 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 CYS N 1.0 140.0 180.0 PSI 101 101 A 63 GLU C A 64 CYS N A 64 CYS CA A 64 CYS C 1.0 -147.9 -91.1 PHI 102 102 A 64 CYS N A 64 CYS CA A 64 CYS C A 65 ARG N 1.0 132.7 172.7 PSI 103 103 A 64 CYS C A 65 ARG N A 65 ARG CA A 65 ARG C 1.0 -158.8 -116.8 PHI 104 104 A 65 ARG N A 65 ARG CA A 65 ARG C A 66 TYR N 1.0 128.7 183.5 PSI 105 105 A 65 ARG C A 66 TYR N A 66 TYR CA A 66 TYR C 1.0 -153.7 -110.1 PHI 106 106 A 66 TYR N A 66 TYR CA A 66 TYR C A 67 GLY N 1.0 133.4 174.7 PSI 107 107 A 66 TYR C A 67 GLY N A 67 GLY CA A 67 GLY C 1.0 -210.6 -92.4 PHI 108 108 A 67 GLY N A 67 GLY CA A 67 GLY C A 68 LEU N 1.0 75.3 215.3 PSI 109 109 A 67 GLY C A 68 LEU N A 68 LEU CA A 68 LEU C 1.0 -159.8 -101.4 PHI 110 110 A 68 LEU N A 68 LEU CA A 68 LEU C A 69 PHE N 1.0 109.4 151.9 PSI 111 111 A 68 LEU C A 69 PHE N A 69 PHE CA A 69 PHE C 1.0 -153.7 -90.5 PHI 112 112 A 69 PHE N A 69 PHE CA A 69 PHE C A 70 ASP N 1.0 103.3 146.4 PSI 113 113 A 69 PHE C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -131.9 -60.6 PHI 114 114 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 PHE N 1.0 83.5 156.1 PSI 115 115 A 70 ASP C A 71 PHE N A 71 PHE CA A 71 PHE C 1.0 -137.7 -78.5 PHI 116 116 A 71 PHE N A 71 PHE CA A 71 PHE C A 72 GLU N 1.0 100.3 155.5 PSI 117 117 A 71 PHE C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -145.2 -90.8 PHI 118 118 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 TYR N 1.0 110.7 169.1 PSI 119 119 A 72 GLU C A 73 TYR N A 73 TYR CA A 73 TYR C 1.0 -186.7 -99.4 PHI 120 120 A 73 TYR N A 73 TYR CA A 73 TYR C A 74 MET N 1.0 129.9 187.3 PSI 121 121 A 73 TYR C A 74 MET N A 74 MET CA A 74 MET C 1.0 -157.3 -68.2 PHI 122 122 A 74 MET N A 74 MET CA A 74 MET C A 75 HIS N 1.0 105.3 154.2 PSI 123 123 A 74 MET C A 75 HIS N A 75 HIS CA A 75 HIS C 1.0 -134.4 -69.6 PHI 124 124 A 75 HIS N A 75 HIS CA A 75 HIS C A 76 GLN N 1.0 101.7 167.2 PSI 125 125 A 75 HIS C A 76 GLN N A 76 GLN CA A 76 GLN C 1.0 -163.4 -79.2 PHI 126 126 A 76 GLN N A 76 GLN CA A 76 GLN C A 77 CYS N 1.0 115.6 156.8 PSI 127 127 A 76 GLN C A 77 CYS N A 77 CYS CA A 77 CYS C 1.0 -157.9 -72.9 PHI 128 128 A 77 CYS N A 77 CYS CA A 77 CYS C A 78 GLN N 1.0 93.4 163.0 PSI 129 129 A 78 GLN C A 79 GLY N A 79 GLY CA A 79 GLY C 1.0 47.5 110.4 PHI 130 130 A 79 GLY N A 79 GLY CA A 79 GLY C A 80 THR N 1.0 -34.8 49.1 PSI 131 131 A 79 GLY C A 80 THR N A 80 THR CA A 80 THR C 1.0 -139.6 -60.2 PHI 132 132 A 80 THR N A 80 THR CA A 80 THR C A 81 SER N 1.0 94.9 211.4 PSI 133 133 A 81 SER C A 82 GLU N A 82 GLU CA A 82 GLU C 1.0 -142.0 -43.4 PHI 134 134 A 82 GLU N A 82 GLU CA A 82 GLU C A 83 SER N 1.0 -60.2 32.0 PSI 135 135 A 83 SER C A 84 SER N A 84 SER CA A 84 SER C 1.0 -190.4 -50.4 PHI 136 136 A 84 SER N A 84 SER CA A 84 SER C A 85 LYS N 1.0 80.7 220.7 PSI 137 137 A 84 SER C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -178.7 -38.7 PHI 138 138 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 LYS N 1.0 73.1 169.0 PSI 139 139 A 85 LYS C A 86 LYS N A 86 LYS CA A 86 LYS C 1.0 -164.4 -74.8 PHI 140 140 A 86 LYS N A 86 LYS CA A 86 LYS C A 87 GLN N 1.0 84.1 221.3 PSI 141 141 A 86 LYS C A 87 GLN N A 87 GLN CA A 87 GLN C 1.0 -134.4 -78.0 PHI 142 142 A 87 GLN N A 87 GLN CA A 87 GLN C A 88 LYS N 1.0 106.8 163.9 PSI 143 143 A 87 GLN C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -179.7 -96.8 PHI 144 144 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 LEU N 1.0 126.0 166.0 PSI 145 145 A 88 LYS C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -155.1 -60.2 PHI 146 146 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 PHE N 1.0 98.7 166.0 PSI 147 147 A 89 LEU C A 90 PHE N A 90 PHE CA A 90 PHE C 1.0 -158.4 -109.5 PHI 148 148 A 90 PHE N A 90 PHE CA A 90 PHE C A 91 LEU N 1.0 133.9 173.9 PSI 149 149 A 90 PHE C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -150.9 -100.9 PHI 150 150 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 MET N 1.0 118.8 160.5 PSI 151 151 A 91 LEU C A 92 MET N A 92 MET CA A 92 MET C 1.0 -148.0 -99.8 PHI 152 152 A 92 MET N A 92 MET CA A 92 MET C A 93 SER N 1.0 105.1 155.2 PSI 153 153 A 92 MET C A 93 SER N A 93 SER CA A 93 SER C 1.0 -138.4 -77.6 PHI 154 154 A 93 SER N A 93 SER CA A 93 SER C A 94 TRP N 1.0 95.5 141.8 PSI 155 155 A 93 SER C A 94 TRP N A 94 TRP CA A 94 TRP C 1.0 -147.5 -81.9 PHI 156 156 A 94 TRP N A 94 TRP CA A 94 TRP C A 95 CYS N 1.0 99.0 172.9 PSI 157 157 A 94 TRP C A 95 CYS N A 95 CYS CA A 95 CYS C 1.0 -175.3 -35.3 PHI 158 158 A 95 CYS N A 95 CYS CA A 95 CYS C A 96 PRO N 1.0 75.0 191.1 PSI 159 159 A 96 PRO C A 97 ASP N A 97 ASP CA A 97 ASP C 1.0 -80.0 -40.0 PHI 160 160 A 97 ASP N A 97 ASP CA A 97 ASP C A 98 THR N 1.0 -45.9 -5.9 PSI 161 161 A 97 ASP C A 98 THR N A 98 THR CA A 98 THR C 1.0 -133.4 -71.9 PHI 162 162 A 98 THR N A 98 THR CA A 98 THR C A 99 ALA N 1.0 -24.5 15.5 PSI 163 163 A 100 LYS C A 101 VAL N A 101 VAL CA A 101 VAL C 1.0 -80.5 -40.5 PHI 164 164 A 101 VAL N A 101 VAL CA A 101 VAL C A 102 LYS N 1.0 -62.9 -22.9 PSI 165 165 A 101 VAL C A 102 LYS N A 102 LYS CA A 102 LYS C 1.0 -82.3 -42.3 PHI 166 166 A 102 LYS N A 102 LYS CA A 102 LYS C A 103 LYS N 1.0 -57.2 -17.2 PSI 167 167 A 102 LYS C A 103 LYS N A 103 LYS CA A 103 LYS C 1.0 -85.4 -45.4 PHI 168 168 A 103 LYS N A 103 LYS CA A 103 LYS C A 104 LYS N 1.0 -60.6 -20.6 PSI 169 169 A 103 LYS C A 104 LYS N A 104 LYS CA A 104 LYS C 1.0 -81.8 -41.8 PHI 170 170 A 104 LYS N A 104 LYS CA A 104 LYS C A 105 MET N 1.0 -57.4 -17.4 PSI 171 171 A 104 LYS C A 105 MET N A 105 MET CA A 105 MET C 1.0 -83.5 -43.5 PHI 172 172 A 105 MET N A 105 MET CA A 105 MET C A 106 LEU N 1.0 -61.4 -21.4 PSI 173 173 A 105 MET C A 106 LEU N A 106 LEU CA A 106 LEU C 1.0 -85.1 -45.1 PHI 174 174 A 106 LEU N A 106 LEU CA A 106 LEU C A 107 TYR N 1.0 -58.7 -18.7 PSI 175 175 A 106 LEU C A 107 TYR N A 107 TYR CA A 107 TYR C 1.0 -85.0 -45.0 PHI 176 176 A 107 TYR N A 107 TYR CA A 107 TYR C A 108 SER N 1.0 -58.5 -18.5 PSI 177 177 A 107 TYR C A 108 SER N A 108 SER CA A 108 SER C 1.0 -86.3 -46.3 PHI 178 178 A 108 SER N A 108 SER CA A 108 SER C A 109 SER N 1.0 -59.2 -19.2 PSI 179 179 A 108 SER C A 109 SER N A 109 SER CA A 109 SER C 1.0 -84.5 -44.5 PHI 180 180 A 109 SER N A 109 SER CA A 109 SER C A 110 SER N 1.0 -45.5 -5.5 PSI 181 181 A 109 SER C A 110 SER N A 110 SER CA A 110 SER C 1.0 -89.9 -48.2 PHI 182 182 A 110 SER N A 110 SER CA A 110 SER C A 111 PHE N 1.0 -60.1 2.2 PSI 183 183 A 110 SER C A 111 PHE N A 111 PHE CA A 111 PHE C 1.0 -96.3 -40.9 PHI 184 184 A 111 PHE N A 111 PHE CA A 111 PHE C A 112 ASP N 1.0 -92.1 28.8 PSI 185 185 A 111 PHE C A 112 ASP N A 112 ASP CA A 112 ASP C 1.0 -82.8 -42.8 PHI 186 186 A 112 ASP N A 112 ASP CA A 112 ASP C A 113 ALA N 1.0 -60.2 -20.2 PSI 187 187 A 112 ASP C A 113 ALA N A 113 ALA CA A 113 ALA C 1.0 -85.0 -45.0 PHI 188 188 A 113 ALA N A 113 ALA CA A 113 ALA C A 114 LEU N 1.0 -59.1 -19.1 PSI 189 189 A 113 ALA C A 114 LEU N A 114 LEU CA A 114 LEU C 1.0 -86.1 -46.1 PHI 190 190 A 114 LEU N A 114 LEU CA A 114 LEU C A 115 LYS N 1.0 -60.0 -20.0 PSI 191 191 A 114 LEU C A 115 LYS N A 115 LYS CA A 115 LYS C 1.0 -82.7 -42.7 PHI 192 192 A 115 LYS N A 115 LYS CA A 115 LYS C A 116 LYS N 1.0 -62.5 -22.5 PSI 193 193 A 115 LYS C A 116 LYS N A 116 LYS CA A 116 LYS C 1.0 -85.5 -45.5 PHI 194 194 A 116 LYS N A 116 LYS CA A 116 LYS C A 117 SER N 1.0 -58.8 -18.8 PSI 195 195 A 116 LYS C A 117 SER N A 117 SER CA A 117 SER C 1.0 -110.4 -54.1 PHI 196 196 A 117 SER N A 117 SER CA A 117 SER C A 118 LEU N 1.0 -60.5 -1.1 PSI 197 197 A 117 SER C A 118 LEU N A 118 LEU CA A 118 LEU C 1.0 -133.3 -61.1 PHI 198 198 A 118 LEU N A 118 LEU CA A 118 LEU C A 119 VAL N 1.0 -50.2 59.8 PSI 199 199 A 118 LEU C A 119 VAL N A 119 VAL CA A 119 VAL C 1.0 -116.8 14.2 PHI 200 200 A 119 VAL N A 119 VAL CA A 119 VAL C A 120 GLY N 1.0 70.9 209.5 PSI 201 201 A 121 VAL C A 122 GLN N A 122 GLN CA A 122 GLN C 1.0 -128.1 -68.5 PHI 202 202 A 122 GLN N A 122 GLN CA A 122 GLN C A 123 LYS N 1.0 -73.3 7.8 PSI 203 203 A 122 GLN C A 123 LYS N A 123 LYS CA A 123 LYS C 1.0 -193.0 -94.0 PHI 204 204 A 123 LYS N A 123 LYS CA A 123 LYS C A 124 TYR N 1.0 111.9 178.9 PSI 205 205 A 123 LYS C A 124 TYR N A 124 TYR CA A 124 TYR C 1.0 -154.0 -92.4 PHI 206 206 A 124 TYR N A 124 TYR CA A 124 TYR C A 125 ILE N 1.0 113.4 167.3 PSI 207 207 A 124 TYR C A 125 ILE N A 125 ILE CA A 125 ILE C 1.0 -148.7 -104.3 PHI 208 208 A 125 ILE N A 125 ILE CA A 125 ILE C A 126 GLN N 1.0 105.8 166.4 PSI 209 209 A 125 ILE C A 126 GLN N A 126 GLN CA A 126 GLN C 1.0 -126.8 -73.1 PHI 210 210 A 126 GLN N A 126 GLN CA A 126 GLN C A 127 ALA N 1.0 103.3 143.3 PSI 211 211 A 126 GLN C A 127 ALA N A 127 ALA CA A 127 ALA C 1.0 -161.8 -71.9 PHI 212 212 A 127 ALA N A 127 ALA CA A 127 ALA C A 128 THR N 1.0 113.4 184.0 PSI 213 213 A 127 ALA C A 128 THR N A 128 THR CA A 128 THR C 1.0 -165.0 -59.1 PHI 214 214 A 129 ASP N A 129 ASP CA A 129 ASP C A 130 LEU N 1.0 146.9 186.9 PSI 215 215 A 129 ASP C A 130 LEU N A 130 LEU CA A 130 LEU C 1.0 -84.0 -44.0 PHI 216 216 A 130 LEU N A 130 LEU CA A 130 LEU C A 131 SER N 1.0 -55.1 -15.1 PSI 217 217 A 130 LEU C A 131 SER N A 131 SER CA A 131 SER C 1.0 -86.9 -46.9 PHI 218 218 A 131 SER N A 131 SER CA A 131 SER C A 132 GLU N 1.0 -55.6 -15.6 PSI 219 219 A 131 SER C A 132 GLU N A 132 GLU CA A 132 GLU C 1.0 -108.8 -50.0 PHI 220 220 A 132 GLU N A 132 GLU CA A 132 GLU C A 133 ALA N 1.0 -52.4 7.5 PSI 221 221 A 132 GLU C A 133 ALA N A 133 ALA CA A 133 ALA C 1.0 -190.6 -50.6 PHI 222 222 A 134 SER N A 134 SER CA A 134 SER C A 135 ARG N 1.0 130.0 179.7 PSI 223 223 A 134 SER C A 135 ARG N A 135 ARG CA A 135 ARG C 1.0 -77.7 -37.7 PHI 224 224 A 135 ARG N A 135 ARG CA A 135 ARG C A 136 GLU N 1.0 -62.5 -22.4 PSI 225 225 A 135 ARG C A 136 GLU N A 136 GLU CA A 136 GLU C 1.0 -81.2 -41.2 PHI 226 226 A 136 GLU N A 136 GLU CA A 136 GLU C A 137 ALA N 1.0 -60.2 -20.2 PSI 227 227 A 136 GLU C A 137 ALA N A 137 ALA CA A 137 ALA C 1.0 -85.0 -45.0 PHI 228 228 A 137 ALA N A 137 ALA CA A 137 ALA C A 138 VAL N 1.0 -59.8 -19.8 PSI 229 229 A 137 ALA C A 138 VAL N A 138 VAL CA A 138 VAL C 1.0 -85.8 -45.8 PHI 230 230 A 138 VAL N A 138 VAL CA A 138 VAL C A 139 GLU N 1.0 -63.2 -23.2 PSI 231 231 A 138 VAL C A 139 GLU N A 139 GLU CA A 139 GLU C 1.0 -79.7 -39.7 PHI 232 232 A 139 GLU N A 139 GLU CA A 139 GLU C A 140 GLU N 1.0 -62.8 -22.8 PSI 233 233 A 139 GLU C A 140 GLU N A 140 GLU CA A 140 GLU C 1.0 -80.0 -40.0 PHI 234 234 A 140 GLU N A 140 GLU CA A 140 GLU C A 141 LYS N 1.0 -63.6 -23.6 PSI 235 235 A 140 GLU C A 141 LYS N A 141 LYS CA A 141 LYS C 1.0 -89.5 -49.5 PHI 236 236 A 141 LYS N A 141 LYS CA A 141 LYS C A 142 LEU N 1.0 -60.6 -20.6 PSI 237 237 A 141 LYS C A 142 LEU N A 142 LEU CA A 142 LEU C 1.0 -83.4 -43.4 PHI 238 238 A 142 LEU N A 142 LEU CA A 142 LEU C A 143 ARG N 1.0 -55.7 -15.7 PSI 239 239 A 142 LEU C A 143 ARG N A 143 ARG CA A 143 ARG C 1.0 -86.9 -46.9 PHI 240 240 A 143 ARG N A 143 ARG CA A 143 ARG C A 144 ALA N 1.0 -59.9 -19.9 PSI 241 241 A 143 ARG C A 144 ALA N A 144 ALA CA A 144 ALA C 1.0 -89.7 -49.7 PHI 242 242 A 144 ALA N A 144 ALA CA A 144 ALA C A 145 THR N 1.0 -45.6 -5.6 PSI 243 243 A 144 ALA C A 145 THR N A 145 THR CA A 145 THR C 1.0 -123.4 -61.6 PHI 244 244 A 145 THR N A 145 THR CA A 145 THR C A 146 ASP N 1.0 -35.4 13.4 PSI 245 245 A 146 ASP C A 147 ARG N A 147 ARG CA A 147 ARG C 1.0 -144.4 -36.6 PHI 246 246 A 147 ARG N A 147 ARG CA A 147 ARG C A 148 GLN N 1.0 95.7 165.6 PSI stop_ save_